18383-59-0 (野菊花醇,Cyclopropanemethanol,2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1R,3S)-rel-)

CAS号:
18383-59-0
中文名称:
野菊花醇
英文名称:
Cyclopropanemethanol,2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1R,3S)-rel-
分子式:
C10H18O
分子量:
154.249323368073

野菊花醇(18383-59-0)名称与标识符

名称

中文别名:
(±)-菊醇;2,2-二甲基-3-(2-甲基丙烯基)环丙烷甲醇;野菊花醇;
英文别名:
Cyclopropanemethanol,2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1R,3S)-rel-;CHRYSANTHEMYL ALCOHOL;CHRYSANTHEMOL;cis-Chrysanthemol;Mixtureofcis-andtrans-isomeres;trans-Chrysanthemol;trans-Chrysanthemum-alkohol;(Z)-chrysanthenol;CHRYSANTHEMYL ALCOHOL(RG);2,2-DIMETHYL-3-(2-METHYLPROPENYL)CYCLOPROPANEMETHANOL;[2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropyl]methanol;78780-10-6;[2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropyl]methanol, cis-;RZX8L555LG;E2NKN25QX4;UNII-E2NKN25QX4;Cyclopropanemethanol, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1R-cis)-;(Z)-Chrysanthemol;cis-Chrysanthemyl alcohol;UNII-RZX8L555LG;Cyclopropanemethanol, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, cis-;cis-(+)-Chrysanthemyl alcohol;Cyclopropanemethanol 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1R,3S);SCHEMBL10988316;Cyclopropanemethanol, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1R,3S)-rel-;[(1R,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]methanol;Chrysanthemol, cis-;18383-59-0;HIPIENNKVJCMAP-DTWKUNHWSA-N;(+/-)-cis-Chrysanthemol;((1R,3S)-2,2-Dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl)methanol;Chrysanthemol, (1R,3S)-;(1R-cis)-Chrysanthemyl alcohol;

标识符

InChIKey:
HIPIENNKVJCMAP-DTWKUNHWSA-N
Inchi:
1S/C10H18O/c1-7(2)5-8-9(6-11)10(8,3)4/h5,8-9,11H,6H2,1-4H3/t8-,9+/m0/s1
SMILES:
OC[C@@H]1[C@H](/C=C(\C)/C)C1(C)C

野菊花醇(18383-59-0)物化性质

实验特性

  • LogP : 2.21710
  • PSA : 20.23000
  • 折射率 : n20/D 1.475(lit.)
  • 沸点 : 66-69 °C0.07 mm Hg(lit.)
  • 闪点 : 185 °F
  • 密度 : 0.888 g/mL at 25 °C(lit.)

计算特性

  • 精确分子量 : 154.13600
  • 氢键供体数量 : 1
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 2
  • 同位素质量 : 154.136
  • 重原子数量 : 11
  • 复杂度 : 175
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 2
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 2.5
  • 拓扑分子极性表面积 : 20.2A^2

野菊花醇(18383-59-0)安全信息

野菊花醇(18383-59-0) MSDS

基础信息

Name:Chrysanthemyl alcohol 98% mixture of cis and trans Material Safety Data Sheet
Synonym:2,2-Dimethyl-3-(2-methylpropenyl)cyclopropanemethano
CAS:18383-59-0
Section 1 - Chemical Product ? MSDS Name:Chrysanthemyl alcohol 98% mixture of cis and trans Material Safety Data Sheet
Synonym:2,2-Dimethyl-3-(2-methylpropenyl)cyclopropanemethano

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
18383-59-0Chrysanthemyl alcohol, mixture of cis98unlisted
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
May cause eye irritation. May cause chemical conjunctivitis and corneal damage.
Skin:
May cause irritation and dermatitis. May cause cyanosis of the extremities.
Ingestion:
May cause gastrointestinal irritation with nausea, vomiting and diarrhea. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated. Aspiration may lead to pulmonary edema. Inhalation at high concentrations may cause CNS depression and asphixiation.
Chronic:
No information found.

Section 4 - FIRST AID MEASURES
? Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse.
Ingestion:
Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
? General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Use water spray to keep fire-exposed containers cool. Combustible liquid.
Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Containers may explode when heated.
Extinguishing Media:
Use water spray to cool fire-exposed containers. Water may be ineffective. Use agent most appropriate to extinguish fire. Use water spray, dry chemical, carbon dioxide, or appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Cover with sand, dry lime or soda ash and place in a closed container for disposal. Remove all sources of ignition. Use a spark-proof tool. Provide ventilation.

Section 7 - HANDLING and STORAGE
? Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use only in a well-ventilated area. Avoid contact with eyes, skin, and clothing. Empty containers retain product residue, (liquid and/or vapor), and can be dangerous. Keep container tightly closed. Keep away from heat, sparks and flame. Avoid ingestion and inhalation. Do not pressurize, cut, weld, braze, solder, drill, grind, or expose empty containers to heat, sparks or open flames.
Storage:
Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
? Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate general or local explosion-proof ventilation to keep airborne levels to acceptable levels.
Exposure Limits CAS# 18383-59-0: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Clear liquid
Color: clear yellow
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 66.0 - 69.0 deg C @ .07mmHg
Freezing/Melting Point: Not available.
Autoignition Temperature: Not applicable.
Flash Point: 85 deg C ( 185.00 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: Not available.
Solubility in water: Not available.
Specific Gravity/Density: .8880g/cm3
Molecular Formula: C10H18O
Molecular Weight: 154.25

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, ignition sources, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Strong oxidizing agents, acid anhydrides, acid chlorides.
Hazardous Decomposition Products:
Carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 18383-59-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Chrysanthemyl alcohol, mixture of cis and trans - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
?

Section 13 - DISPOSAL CONSIDERATIONS
? Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
?
IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
S 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 18383-59-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 18383-59-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 18383-59-0 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A