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6001-74-7 | CHLORMETHIAZOLE HYDROCHLORIDE
CAS No: 6001-74-7 Catalog No: AG00EFW5 MDL No:MFCD00673948
Product Description
Catalog Number:
AG00EFW5
Chemical Name:
CHLORMETHIAZOLE HYDROCHLORIDE
CAS Number:
6001-74-7
Molecular Formula:
C6H9Cl2NS
Molecular Weight:
198.1134
MDL Number:
MFCD00673948
IUPAC Name:
5-(2-chloroethyl)-4-methyl-1,3-thiazole;hydrochloride
InChI:
InChI=1S/C6H8ClNS.ClH/c1-5-6(2-3-7)9-4-8-5;/h4H,2-3H2,1H3;1H
InChI Key:
OFXYKSLKNMTBHK-UHFFFAOYSA-N
SMILES:
Cc1ncsc1CCCl.Cl
EC Number:
611-928-6
UNII:
85223EMG44
Properties
Complexity:
89.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.983g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.105g/mol
Monoisotopic Mass:
196.983g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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