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(6r,7r)-7-Amino-3-(Hydroxymethyl)-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid

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(6R,7R)-7-Amino-3-(Hydroxymethyl)-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid / CAS : 15690-38-7

Appearance This product is solid at room temperature. UN 0
HS 29349990 DG Class 0
Synonyms Hydroxymethyl-7-Aca; Hydroxymethyl-7-Aminocephalosporanic Acid; (6R-Trans)-7-Amino-3-(Hydroxymethyl)-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylic Acid; Daca; Intermediate Of Cefoselis Sulfate (7-Amino-3-(Hydroxymethyl)-3-Cephem-4-Carboxylic Acid ); 7-(Phenylacetylamino)Deacetylcephalosporanic Acid; D-7 ACA; Deacety l-7-Amino Cephalosporanic Acid; Desacetyl- 7-Amino Cephalosporanic ACID; D 7ACA
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Properties

Summary

Formula
C8H10N2O4S
Molecular Mass
230.24100
Exact Mass
230.03600
PSA
129.16000
Logp
-0.80200
IUPAC
(6R,7R)-7-amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SMILES
C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)CO

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Melting Point
227-236°C
Density
1.749 g/cm3
Boiling Point
617.905ºC
Flash Point
327.498ºC
Appearance
This product is solid at room temperature.
Acidity and Basicity
acidness

Export information

HS Code
29349990
Export Rebate
13%
UN No.
0
DG-Class
0

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