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7-Amino-3-Methyl-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid

7-Amino-3-Methyl-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid / CAS : 26395-99-3

Appearance solid UN -
HS 29349960 DG Class -
Synonyms 7-Adca; 7-Amino-3-Deacetoxycephalosporanic Acid; 7-Amino-3-Methyl-8-Oxo-5-Thia-1-Aza-Bicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; (6R,7R)-7-Aminodeacetoxycephalosporanic Acid; 7-Aminodesacetoxycephalosporanic Acid; (6R,7R)-7-Aminodesacetoxycephalosporanic Acid; Unii-Anm3Msm8Tn; 3-Deacetyloxy-7-Aminocephalosporanic Acid
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Properties

Summary

Formula
C8H10N2O3S
Molecular Mass
214.24200
Exact Mass
214.04100
PSA
108.93000
Logp
0.22560
IUPAC
7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES
CC1=C(N2C(C(C2=O)N)SC1)C(=O)O

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials

Chemical and Physical Properties

Density
1.59g/cm3
Boiling Point
517.6ºC
Flash Point
266.8ºC
Appearance
solid

Export information

HS Code
29349960
Export Rebate
13%
Risk Code
R42/43
Safety Label
Xn

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