Home Halogens 4-(sec-butyl)-2-chlorothiazole

4-(sec-butyl)-2-chlorothiazole

CAS No.:
1341922-88-0
Catalog Number:
AG01DTFE
Molecular Formula:
C7H10ClNS
Molecular Weight:
175.6790
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Product Description
Catalog Number:
AG01DTFE
Chemical Name:
4-(sec-butyl)-2-chlorothiazole
CAS Number:
1341922-88-0
Molecular Formula:
C7H10ClNS
Molecular Weight:
175.6790
MDL Number:
MFCD17249926
IUPAC Name:
4-butan-2-yl-2-chloro-1,3-thiazole
InChI:
InChI=1S/C7H10ClNS/c1-3-5(2)6-4-10-7(8)9-6/h4-5H,3H2,1-2H3
InChI Key:
QWMHSHJZVJIHKV-UHFFFAOYSA-N
SMILES:
CC(c1csc(n1)Cl)CC
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.022g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.674g/mol
Monoisotopic Mass:
175.022g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties