CAS 128173-53-5|(2S,3S)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid,4-[(1S)-4-(dimethylamino)-1-(4

Introduction：Basic information about CAS 128173-53-5|(2S,3S)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid,4-[(1S)-4-(dimethylamino)-1-(4, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Safety Information
4. Synonyms

Common Name	(2S,3S)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid,4-[(1S)-4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile
CAS Number	128173-53-5	Molecular Weight	1071.167
Density	/	Boiling Point	/
Molecular Formula	C₆₀H₆₄F₂N₄O₁₂	Melting Point	134-135ºC
MSDS	/	Flash Point	/

Names

Name	(2S,3S)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid,4-[(1S)-4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile
Synonym	More Synonyms

Chemical & Physical Properties

Melting Point	134-135ºC
Molecular Formula	C₆₀H₆₄F₂N₄O₁₂
Molecular Weight	1071.167
Exact Mass	1070.448853
PSA	262.18000
LogP	7.75836
InChIKey	XADVDTANOZJZTP-WQXCQFITSA-N
SMILES	CN(C)CCCC(O)(c1ccc(F)cc1)c1ccc(C#N)cc1CO.CN(C)CCCC(O)(c1ccc(F)cc1)c1ccc(C#N)cc1CO.Cc1ccc(C(=O)OC(C(=O)O)C(OC(=O)c2ccc(C)cc2)C(=O)O)cc1

Safety Information

RIDADR	NONH for all modes of transport

Synonyms

(-)-4-(4-Dimethylamino)-1-(4-fluorophenyl)-1-(hydroxybuty)-3-hy droxymethyl)-benzonitrile hemi D-(+)-di-p-toloyltartaric acid salt

Butanedioic acid, 2,3-bis[(4-methylbenzoyl)oxy]-, (2S,3S)-, compd. with 4-[(1S)-4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile (1:2)

(2S,3S)-2,3-Bis[(4-methylbenzoyl)oxy]succinic acid - 4-[(1S)-4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile (1:2)

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