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Temocillin

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Temocillin / CAS : 66148-78-5

Appearance - UN 0.0
HS 29349990 DG Class 0.0
Synonyms Temocilline; Temocillinum; Temocillina; Einecs 266-184-1; (2S,5R,6S)-6-[(2-Carboxy-2-Thiophen-3-Ylacetyl)Amino]-6-Methoxy-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; Temocillin Sodium; N-((2S,5R,6S)-2-Carboxy-6-Methoxy-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Hept-6-Yl)-3-Thiophenemalonamic Acid; (6S)-6-[2-Carboxy-2-(3-Thienyl)Acetamido]-6-Methoxypenicillanic Acid
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Properties

Summary

Formula
C16H18N2O7S2
Molecular Mass
414.45300
Exact Mass
414.05600
PSA
186.78000
Logp
0.85090
IUPAC
(2S,5R,6S)-6-[(2-carboxy-2-thiophen-3-ylacetyl)amino]-6-methoxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SMILES
CC1(C(N2C(S1)C(C2=O)(NC(=O)C(C3=CSC=C3)C(=O)O)OC)C(=O)O)C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Antibiotics

Chemical and Physical Properties

Density
1.6 g/cm3
Boiling Point
761.9ºC at 760 mmHg
Acidity and Basicity
acidness

Export information

HS Code
29349990
Export Rebate
10%
UN No.
0.0
DG-Class
0.0

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