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4175-72-8 | 4-Chlorothiazole
CAS No: 4175-72-8 Catalog No: AG003L8L MDL No:MFCD09038604
Product Description
Catalog Number:
AG003L8L
Chemical Name:
4-Chlorothiazole
CAS Number:
4175-72-8
Molecular Formula:
C3H2ClNS
Molecular Weight:
119.5727
MDL Number:
MFCD09038604
IUPAC Name:
4-chloro-1,3-thiazole
InChI:
InChI=1S/C3H2ClNS/c4-3-1-6-2-5-3/h1-2H
InChI Key:
DLRXEPREUKUZQO-UHFFFAOYSA-N
SMILES:
Clc1cscn1
Properties
Complexity:
50.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.96g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
119.566g/mol
Monoisotopic Mass:
118.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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