84793-07-7 (芴甲氧羰基-L-谷氨酸 1-叔丁酯,N-(9-Fluorenylmethoxycarbonyl)glutamic acid α-tert-butyl ester)

快速询单

结构式：

芴甲氧羰基-L-谷氨酸 1-叔丁酯MOL文件

CAS号：

84793-07-7

中文名称：

芴甲氧羰基-L-谷氨酸 1-叔丁酯

英文名称：

N-(9-Fluorenylmethoxycarbonyl)glutamic acid α-tert-butyl ester

分子式：

C₂₄H₂₇NO₆

分子量：

425.4742872715

简介：

N-(9-Fluorenylmethoxycarbonyl)glutamic acid α-tert-butyl ester 是一种谷氨酸衍生物。

芴甲氧羰基-L-谷氨酸 1-叔丁酯(84793-07-7)名称与标识符

名称

中文别名：

芴甲氧羰基-L-谷氨酸 1-叔丁酯;Fmoc-L-谷氨酸 1-叔丁酯;Fmoc-L-谷氨酸 1-叔丁酯,Fmoc-L-Glutamic acid 1-tert-butyl ester;FMOC-谷氨酸-OTBU;N-芴甲氧羰基-L-谷氨酸1-叔丁酯;芴甲氧羰基-L-谷氨酸 1-叔丁酯 Fmoc-Glu-OtBu;芴甲氧羰基-L-谷氨酸1叔丁脂;芴甲氧羰基-L-谷氨酸-1-叔丁脂;芴甲氧羰基-L-谷氨酸-1-叔丁酯;芴甲氧羰基-L谷氨酸-1-叔丁酯;Fmoc-L-谷氨酸-1-叔丁酯;

英文别名：

Fmoc-L-Glutamic acid 1-tert-butyl ester;N-(9-Fluorenylmethoxycarbonyl)glutamic acid α-tert-butyl ester;(4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;FMOC-GLU-OBUT;Fmoc-Glu-OtBu;Fmoc-L-Glu-OtBu;Fmoc-L-glutamic acid α-tert.butyl ester;N-Fmoc-L-glutamic acid 1-tert-butyl ester;Fmoc-L-Glu-O-t-Bu;Fmoc-Glu-O-t-Bu;Fmoc-Glu(OBut)-OH;(S)-4-(((9H-fluoren-9-yl)methoxy)carbonylamino)-5-tert-butoxy-5-oxopentanoic acid;Fmoc-Glu-Ot-Bu;PubChem10014;KSC448A0B;GOPWHXPXSPIIQZ-FQEVSTJZSA-N;BCP26020;C;(4S)-5-(tert-Butoxy)-4-([[(9H-fluoren-9-yl)methoxy]carbonyl]amino)-5-oxopentanoic acid;10: PN: CN1962691 PAGE: 3 claimed protein;

标识符

MDL：

MFCD00065648

InChIKey：

GOPWHXPXSPIIQZ-FQEVSTJZSA-N

Inchi：

1S/C24H27NO6/c1-24(2,3)31-22(28)20(12-13-21(26)27)25-23(29)30-14-19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,19-20H,12-14H2,1-3H3,(H,25,29)(H,26,27)/t20-/m0/s1

SMILES：

C(C1C2C=CC=CC=2C2C=CC=CC1=2)OC(=O)N[C@@H](CCC(=O)O)C(=O)OC(C)(C)C

芴甲氧羰基-L-谷氨酸 1-叔丁酯(84793-07-7)物化性质

实验特性

LogP : 4.49110
PSA : 101.93000
折射率 : 1.57
沸点 : 638.1℃ at 760 mmHg
熔点 : 105-113°C
比旋光度 : -8.0° - -12.0° (c=1, CH3COOH)

计算特性

精确分子量 : 425.18400
氢键供体数量 : 2
氢键受体数量 : 6
可旋转化学键数量 : 10
重原子数量 : 31
复杂度 : 635
拓扑分子极性表面积 : 102

芴甲氧羰基-L-谷氨酸 1-叔丁酯(84793-07-7)安全信息

WGK Germany： 3
安全术语： 8
安全说明： S26; S36/37/39
包装等级： III
风险术语： R34
危险品标志： C
危险品运输编号： UN 3261 8/PG 2
危害声明：H315; H319; H335
警示性声明：P261; P264; P271; P280; P302+P352; P304+P340; P305+P351+P338; P312; P321; P332+P313; P337+P313; P362; P403+P233; P405; P501
储存条件： Store at room temperature
信号词： Warning

芴甲氧羰基-L-谷氨酸 1-叔丁酯(84793-07-7)海关数据

海关编码：

29224290

芴甲氧羰基-L-谷氨酸 1-叔丁酯(84793-07-7)推荐厂家更多厂家(90)

公司名称	手机号/电话	联系人	QQ	询单
湖北信康医药化工有限公司	13476235517 13476235517	杨彩云	1438280055	询单
湖北佩孜医药科技有限公司	17720472265 0712-4220300	龚	2195228001	询单
湖北信康药化有限公司化学研究所	18827031272 027-59308705	肖经理	1438980011	询单
上海源叶生物科技有限公司	15026964105 15026964105	汤思磊	2881489226	询单
山东西亚化学有限公司	13395390286	刘经理	3007715520	询单
上海吉至生化科技有限公司	18117592386 021-57481218	吉至试剂	3007522982	询单
湖北摆渡化学有限公司	13517219350 13517219350	彭星	1400878899	询单
江苏永健医药科技有限公司	17701422016	韩经理	3587493084	询单
郑州阿尔法化工有限公司	15324716602 0371-55013243	刘经理	2853979810	询单
湖北方德新材料有限公司	18086096695	邱经理	1462312301	询单

芴甲氧羰基-L-谷氨酸 1-叔丁酯(84793-07-7)合成路线

合成路线：1 步

82911-69-1

45120-30-7

_85%

84793-07-7

反应条件：

1.1 Reagents: Sodium carbonate Solvents: 1,4-Dioxane , Water

参考文献：

Folate analogs. 33. Synthesis of folate and antifolate poly-γ-glutamates by [(9-fluorenylmethoxy)oxy]carbonyl chemistry and biological evaluation of certain methotrexate polyglutamate polylysine conjugates as inhibitors of the growth of H35 hepatoma cells

Abraham, Ann; Nair, M. G.; Kisliuk, R. L.; Galivan, J.; Gaumont, Y., Journal of Medicinal Chemistry, 1990, 33(2), 711-17

合成路线：1 步

_39%

参考文献：

A simple and convenient synthesis of ω-tert-butyl esters of Fmoc-aspartic and Fmoc-glutamic acids

Lajoie, Gilles; Crivici, Anna; Adamson, J. Gordon, Synthesis, 1990, (7), 571-2

合成路线：1 步

84793-07-7

反应条件：

1.1 Reagents: Diisopropylethylamine , 2-Chlorotrityl chloride resin Solvents: Dichloromethane ; 60 min, rt
1.2 Reagents: Diisopropylethylamine Solvents: Methanol ; 15 min, rt

参考文献：

Improved folate extraction and tracing deconjugation efficiency by dual label isotope dilution assays in foods

Moench, Sabine; Rychlik, Michael, Journal of Agricultural and Food Chemistry, 2012, 60(6), 1363-1372

芴甲氧羰基-L-谷氨酸 1-叔丁酯(84793-07-7)上下游

乙酰胺,2-氯-N-乙基-N-苯基- (9H-芴-9-基)甲基 2,5-二氧代吡咯烷-1-羧酸异丁烯 L-谷氨酸

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芴甲氧羰基-L-谷氨酸 1-叔丁酯(84793-07-7)参考资料

Beilstein：

MFCD00065648

PubChem CID：

7017912

芴甲氧羰基-L-谷氨酸 1-叔丁酯(84793-07-7) MSDS

基础信息

Material Safety Data Sheet

Section 1. Identi?cation of the substance
Product Name: Fmoc-Glu-OtBu
Synonyms: Fmoc-L-glutamic acid, alfa-tert-butyl ester

Section 2. Hazards identi?cation
Harmful by inhalation, in contact with skin, and if swallowed.

Section 3. Composition/information on ingredients.
Ingredient name: Fmoc-Glu-OtBu
CAS number: 84793-07-7

Section 4. First aid measures
    Skin contact:        Immediately wash skin with copious amounts of water for at least 15 minutes while removing
    contaminated clothing and shoes. If irritation persists, seek medical attention.
    Eye contact:        Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate
    ?ushing of the eyes by separating the eyelids with ?ngers. If irritation persists, seek medical
    attention.
    Inhalation:        Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.
    Ingestion:        Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.

Section 5. Fire ?ghting measures
    In the event of a ?re involving this material, alone or in combination with other materials, use dry
    powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
    should be worn.

Section 6. Accidental release measures
    Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
    standards.
    Respiratory precaution:        Wear approved mask/respirator
    Hand precaution:        Wear suitable gloves/gauntlets
    Skin protection:        Wear suitable protective clothing
    Eye protection:        Wear suitable eye protection
    Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
    for disposal. See section 12.
    Environmental precautions: Do not allow material to enter drains or water courses.

Section 7. Handling and storage
    Handling:        This product should be handled only by, or under the close supervision of, those properly quali?ed
    in the handling and use of potentially hazardous chemicals, who should take into account the ?re,
    health and chemical hazard data given on this sheet.
    Store in closed vessels, refrigerated.
    Storage:

Section 8. Exposure Controls / Personal protection
    Engineering Controls: Use only in a chemical fume hood.
    Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
    General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

Section 9. Physical and chemical properties
    Appearance:        Not speci?ed
    Boiling point:        No data
    No data
    Melting point:
    Flash point:        No data
    Density:        No data
    Molecular formula:        C24H27NO6
    Molecular weight:        425.5

Section 10. Stability and reactivity
    Conditions to avoid: Heat, ?ames and sparks.
    Materials to avoid: Oxidizing agents.
    Possible hazardous combustion products: Carbon monoxide, nitrogen oxides.

Section 11. Toxicological information
No data.

Section 12. Ecological information
No data.

Section 13. Disposal consideration
Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
disposal authority, in accordance with national and regional regulations.

Section 14. Transportation information
Non-harzardous for air and ground transportation.

Section 15. Regulatory information
    No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
    302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
    Title III, Section 313.

SECTION 16 - ADDITIONAL INFORMATION
N/A