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GCLE / CAS : 104146-10-3

Appearance White solid UN 0.0
HS 29349960 DG Class 0.0
Synonyms 3-Chloromethyl-7-(2-Phenylacetamido)-3-Cephem-4-Carboxylic Acid 4-Methoxybenzyl Ester; 4-Methoxybenzyl 3-Chloromethyl-7-(2-Phenylacetamido)-3-Cephem-4-Carboxylate; (4-Methoxyphenyl)Methylester,(6R-Trans)-7-((Phenylacetyl)Amino); 7-Phenylacetamido-3-Chloromethylcephem-4-Carbonicacidp-Methoxybenzylester; 7-Phenylacetamino-3-Chloromethyl-3-Cephem4-Carboxylic Acid P-Methoxybenzyl Ester; 7-Phenylacetamide-3-Chloromethyl-Cephalosporanic Acid P-Methoxybenzyl Ester; (6R,7R)-4-Methoxybenzyl 3-(Chloromethyl)-8-oxo-7-(2-Phenylacetamido)-5-thia-1-Azabicyclo[4.2.0]oct-2-ene-2-Carboxylate; (4-Methoxyphenyl)Methyl (6R,7R)-3-(Chloromethyl)-8-oxo-7-[(2-Phenylacetyl)Amino]-5-thia-1-Azabicyclo[4.2.0]oct-2-ene-2-Carboxylate
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Properties

Summary

Formula
C24H23ClN2O5S
Molecular Mass
486.96800
Exact Mass
486.10200
PSA
110.24000
Logp
3.20270
IUPAC
(4-methoxyphenyl)methyl (6R,7R)-3-(chloromethyl)-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SMILES
COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3NC(=O)CC4=CC=CC=C4)CCl

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Melting Point
153-155°C
Density
1.41±0.1 g/cm3(Predicted)
Boiling Point
756.6ºC at 760 mmHg
Flash Point
411.4ºC
Appearance
White solid
Acidity and Basicity
acidness

Export information

HS Code
29349960
Export Rebate
13%
UN No.
0.0
DG-Class
0.0
Risk Code
R22; R41; R43
Safety Label
Xn

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