10314-99-5 (4-氯羰酰四氢-吡啶羧酸苄酯,Benzyl 4-(chlorocarbonyl)piperidine-1-carboxylate)

CAS号:
10314-99-5
中文名称:
4-氯羰酰四氢-吡啶羧酸苄酯
英文名称:
Benzyl 4-(chlorocarbonyl)piperidine-1-carboxylate
分子式:
C14H16ClNO3
分子量:
281.734743118286

4-氯羰酰四氢-吡啶羧酸苄酯(10314-99-5)名称与标识符

名称

中文别名:
4-氯羰酰四氢-吡啶羧酸苄酯;
英文别名:
Benzyl 4-(chlorocarbonyl)piperidine-1-carboxylate;1-BENZYLOXYCARBONYLPIPERIDINE-3-CARBONYL CHLORIDE;1-Piperidinecarboxylicacid, 4-(chlorocarbonyl)-, phenylmethyl ester;Benzyl 4-(chlorocarbonyl)tetrahydro-1(2H)-pyridinecarboxylate;benzyl 4-carbonochloridoylpiperidine-1-carboxylate;1-benzyloxycarbonyl-piperidine-4-carbonyl chloride;1-benzyloxycarbonylpiperidine-4-carboxylic acid chloride;4-chlorocarbonyl-piperidine-1-carboxylic acid benzyl ester;10314-99-5;W-204484;1-CBZ-4-CHLOROCARBONYLPIPERIDINE;AB6166;Benzyl 4-(chlorocarbonyl)tetrahydro-1(2H)-pyridinecarboxylate, AldrichCPR;benzyl 4-(carboxy)piperidine-1-carboxylate;1-benzyloxycarbonyl-4-piperidinecarboxylic acid chloride;Benzyl4-(chlorocarbonyl)piperidine-1-carboxylate;A800685;1-benzyloxycarbonylpiperidine-4-carbonyl chloride;1-benzyloxycarbonylisonipecotic acid chloride;AKOS015848522;Piperidine-4-carbonyl chloride, N-CBZ protected;FT-0622803;1-(benzyloxycarbonyl)piperidin-4-ylcarbonyl chloride;SCHEMBL188053;benzyl-4-(chlorocarbonyl)piperidine-1-carboxylate;SY005980;MFCD02677707;N-Cbz-piperidine-4-carbonyl Chloride;DTXSID00379940;1-Piperidinecarboxylicacid,4-(chlorocarbonyl)-,phenylmethyl ester;CS-10850;BCP08727;N-Benzyloxycarbonylisonipecotyl chloride;KUBUQFFBRSHOMJ-UHFFFAOYSA-N;Benzyl 4-(Carbonochloridoyl)Piperidine-1-Carboxylate;

标识符

MDL:
MFCD02677707
InChIKey:
KUBUQFFBRSHOMJ-UHFFFAOYSA-N
Inchi:
1S/C14H16ClNO3/c15-13(17)12-6-8-16(9-7-12)14(18)19-10-11-4-2-1-3-5-11/h1-5,12H,6-10H2
SMILES:
ClC(C1CCN(C(=O)OCC2C=CC=CC=2)CC1)=O

4-氯羰酰四氢-吡啶羧酸苄酯(10314-99-5)物化性质

实验特性

  • LogP : 2.73850
  • PSA : 46.61000
  • 折射率 : 1.557
  • 沸点 : 396.6°Cat760mmHg
  • 闪点 : 193.6°C
  • 密度 : 1.269

计算特性

  • 精确分子量 : 281.08200
  • 氢键供体数量 : 0
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 5
  • 同位素质量 : 281.082
  • 重原子数量 : 19
  • 复杂度 : 321
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 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) : 2.6
  • 拓扑分子极性表面积 : 46.6A^2

4-氯羰酰四氢-吡啶羧酸苄酯(10314-99-5)安全信息

4-氯羰酰四氢-吡啶羧酸苄酯(10314-99-5)海关数据

海关编码:
2933399090
海关数据:

中国海关编码:

2933399090

概述:

2933399090. 其他结构含非稠合吡啶环的化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素:

品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期

Summary:

2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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4-氯羰酰四氢-吡啶羧酸苄酯(10314-99-5) MSDS

基础信息

Name:Benzyl 4-(chlorocarbonyl)tetrahydro-1(2H)-pyridinecarboxylate 95+% Material Safety Data Sheet
Synonym:4-Chlorocarbonylpiperidine-1-carboxylic acid benzyl este
CAS:10314-99-5
Section 1 - Chemical Product ? MSDS Name:Benzyl 4-(chlorocarbonyl)tetrahydro-1(2H)-pyridinecarboxylate 95+% Material Safety Data Sheet
Synonym:4-Chlorocarbonylpiperidine-1-carboxylic acid benzyl este

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
10314-99-5Benzyl 4-(chlorocarbonyl)tetrahydro-1(95+%unlisted
Hazard Symbols: C
Risk Phrases: 34

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Causes burns.Moisture sensitive.
Potential Health Effects
Eye:
Causes eye burns.
Skin:
Causes skin burns.
Ingestion:
Causes gastrointestinal tract burns.
Inhalation:
Causes chemical burns to the respiratory tract.
Chronic:
Not available.

Section 4 - FIRST AID MEASURES
? Eyes: Immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately.
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Do not induce vomiting. Get medical aid immediately.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen.
Notes to Physician:
Treat symptomatically and supportively.

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.
Extinguishing Media:
Use foam, dry chemical, or carbon dioxide.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container.

Section 7 - HANDLING and STORAGE
? Handling:
Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Use only in a chemical fume hood.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Corrosives area. Store under nitrogen.

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 ventilation to keep airborne concentrations low.
Exposure Limits CAS# 10314-99-5: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Viscous liquid
Color: Clear
Odor: characteristic odor
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C14H16ClNO3
Molecular Weight: 282

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials, exposure to moist air or water.
Incompatibilities with Other Materials:
Strong oxidizing agents, reducing agents, acids, bases, alcohols, amines.
Hazardous Decomposition Products:
Hydrogen chloride, chlorine, nitrogen oxides, carbon monoxide, carbon dioxide, acrid smoke and fumes.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 10314-99-5 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Benzyl 4-(chlorocarbonyl)tetrahydro-1(2H)-pyridinecarboxylate - 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
Shipping Name: CORROSIVE LIQUID, ACIDIC, ORGANIC, N.O.S.*
Hazard Class: 8
UN Number: 3265
Packing Group: III
IMO
Shipping Name: CORROSIVE LIQUID, ACIDIC, ORGANIC, N.O.S.
Hazard Class: 8
UN Number: 3265
Packing Group: III
RID/ADR
Shipping Name: CORROSIVE LIQUID, ACIDIC, ORGANIC, N.O.S.
Hazard Class: 8
UN Number: 3265
Packing group: III

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 34 Causes burns.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
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# 10314-99-5: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 10314-99-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 10314-99-5 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A