CAS 491878-06-9|4-NITROBENZYL (2S,4S)-4-ACETYLTHIO-2-((N-SULFAMOYL-N-(TERT-BUTOXYCARBONYL)AMI

Introduction：Basic information about CAS 491878-06-9|4-NITROBENZYL (2S,4S)-4-ACETYLTHIO-2-((N-SULFAMOYL-N-(TERT-BUTOXYCARBONYL)AMI, 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. Customs
5. Synonyms

Common Name	4-NITROBENZYL (2S,4S)-4-ACETYLTHIO-2-((N-SULFAMOYL-N-(TERT-BUTOXYCARBONYL)AMINO)METHYL)PYRROLIDINE-1-CARBOXYLATE
CAS Number	491878-06-9	Molecular Weight	532.588
Density	1.5±0.1 g/cm3	Boiling Point	686.8±65.0 °C at 760 mmHg
Molecular Formula	C₂₀H₂₈N₄O₉S₂	Melting Point	124-132ºC
MSDS	/	Flash Point	369.2±34.3 °C

Names

Name	(4-nitrophenyl)methyl (2S,4S)-4-acetylsulfanyl-2-[[(2-methylpropan-2-yl)oxycarbonyl-sulfamoylamino]methyl]pyrrolidine-1-carboxylate
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.5±0.1 g/cm3
Boiling Point	686.8±65.0 °C at 760 mmHg
Melting Point	124-132ºC
Molecular Formula	C₂₀H₂₈N₄O₉S₂
Molecular Weight	532.588
Flash Point	369.2±34.3 °C
Exact Mass	532.129761
PSA	215.81000
LogP	1.35
Vapour Pressure	0.0±2.1 mmHg at 25°C
Index of Refraction	1.616
InChIKey	JECWBBGYVBPHIH-IAGOWNOFSA-N
SMILES	CC(=O)SC1CC(CN(C(=O)OC(C)(C)C)S(N)(=O)=O)N(C(=O)OCc2ccc([N+](=O)[O-])cc2)C1

Safety Information

Hazard Codes	Xi
HS Code	2935009090

Customs

HS Code	2935009090
Summary	2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0%

Synonyms

4-Nitrobenzyl (2S,4S)-4-(acetylsulfanyl)-2-{[(tert-butoxycarbonyl)(sulfamoyl)amino]methyl}pyrrolidine-1-carboxylate

4-Nitrobenzyl (2S,4S)-4-(acetylsulfanyl)-2-{[{[(2-methyl-2-propanyl)oxy]carbonyl}(sulfamoyl)amino]methyl}-1-pyrrolidinecarboxylate

4-Nitrobenzyl (2S,4S)-4-acetylthio-2-[[N-sulfamoyl-N-(tert-butoxycarbonyl)amino]methyl]pyrrolidine-1-carboxylate

1-Pyrrolidinecarboxylic acid, 4-(acetylthio)-2-[[(aminosulfonyl)[(1,1-dimethylethoxy)carbonyl]amino]methyl]-, (4-nitrophenyl)methyl ester, (2S,4S)-

Doripenem side-chain

4-NITROBENZYL (2S,4S)-4-ACETYLTHIO-2-((N-SULFAMOYL-N-(TERT-BUTOXYCARBONYL)AMINO)METHYL)PYRROLIDINE-1-CARBOXYLATE

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