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3-[(E)-[[(1R,2R)-2-[[(1S)-1-[(Dimethylamino)carbonyl]-2,2-dimethylpropyl]thioureido]cyclohexyl]imino]methyl]-5-(tert-butyl)-4-hydroxyphenyl pivalate_Molecular_structure_CAS_462632-54-8)
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3-[(E)-[[(1R,2R)-2-[[(1S)-1-[(Dimethylamino)carbonyl]-2,2-dimethylpropyl]thioureido]cyclohexyl]imino]methyl]-5-(tert-butyl)-4-hydroxyphenyl pivalate

Catalog No. 693421 Name Sigma Aldrich
CAS Number 462632-54-8 Website http://www.sigmaaldrich.com
M. F. C31H50N4O4S Telephone 1-800-521-8956
M. W. 574.8181 Fax
Purity 95% Email
Storage Chembase ID: 141429

SYNONYMS

Title
3-[(E)-[[(1R,2R)-2-[[(1S)-1-[(二甲氨基)羰基]-2,2-二甲基丙基]硫脲基]环己基]亚氨基]甲基]-5-(叔丁基)-4-羟基苯基新戊酸酯
IUPAC name
3-tert-butyl-5-{N-[(1R,2R)-2-({[(1S)-1-(dimethylcarbamoyl)-2,2-dimethylpropyl]carbamothioyl}amino)cyclohexyl]carboximidoyl}-4-hydroxyphenyl 2,2-dimethylpropanoate
IUPAC Traditional name
3-tert-butyl-5-{N-[(1R,2R)-2-({[(1S)-1-(dimethylcarbamoyl)-2,2-dimethylpropyl]carbamothioyl}amino)cyclohexyl]carboximidoyl}-4-hydroxyphenyl 2,2-dimethylpropanoate
Synonyms
3-[[[(1R,2R)-2-[[[[(1S)-1-[(二甲氨基)羰基]-2,2-二甲基丙基]氨基]硫代甲基]氨基]环己基]亚氨基]甲基]-5-(1,1-二甲基乙基)-4-羟基苯基 2,2-二甲基丙酸酯
3-[[[(1R,2R)-2-[[[[(1S)-1-[(Dimethylamino)carbonyl]-2,2-dimethylpropyl]amino]thioxomethyl]amino]cyclohexyl]imino]methyl]-5-(1,1-dimethylethyl)-4-hydroxyphenyl 2,2-dimethylpropanoate

DATABASE IDS

MDL Number MFCD10567034
CAS Number 462632-54-8

PROPERTIES

Empirical Formula (Hill Notation) C31H50N4O4S
Mw/Mn <1.2
Purity 95%
Melting Point 135-138 °C (D)
Optical Rotation [α]20/D -88°, c = 1 in chloroform
GHS Pictograms GHS07
GHS Signal Word Warning
GHS Hazard statements H315-H319-H335
European Hazard Symbols Irritant Irritant (Xi)
MSDS Link Download
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
GHS Precautionary statements P261-P305 + P351 + P338
Risk Statements 36/37/38
Safety Statements 26-36/37
German water hazard class 3

DETAILS

Description (English)
Application
Catalyst for the Strecker reaction1
Packaging
100, 500 mg in glass bottle
Protocols & Applications
Asymmetric Strecker Reactions using Jacobsen Thioureas
Description (简体中文)
Application
Strecker 反应的催化剂1
包装
100, 500 mg in glass bottle
Protocols & Applications
Asymmetric Strecker Reactions using Jacobsen Thioureas

REFERENCES