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Home > Thiazole > 1006047-44-4
1006047-44-4 | 5-chloro-1,3-thiazole-4-carboxamide
CAS No: 1006047-44-4 Catalog No: AG01BCHD MDL No:MFCD20703031
Product Description
Catalog Number:
AG01BCHD
Chemical Name:
5-chloro-1,3-thiazole-4-carboxamide
CAS Number:
1006047-44-4
Molecular Formula:
C4H3ClN2OS
Molecular Weight:
162.5974
MDL Number:
MFCD20703031
IUPAC Name:
5-chloro-1,3-thiazole-4-carboxamide
InChI:
InChI=1S/C4H3ClN2OS/c5-3-2(4(6)8)7-1-9-3/h1H,(H2,6,8)
InChI Key:
HWBZEMHGDOEIBF-UHFFFAOYSA-N
SMILES:
NC(=O)c1ncsc1Cl
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.965g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.591g/mol
Monoisotopic Mass:
161.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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