Home Halogens 2-chloro-4-(3-nitrophenyl)thiazole

2-chloro-4-(3-nitrophenyl)thiazole

CAS No.:
1188122-55-5
Catalog Number:
AG01DTEA
Molecular Formula:
C9H5ClN2O2S
Molecular Weight:
240.6662
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Product Description
Catalog Number:
AG01DTEA
Chemical Name:
2-chloro-4-(3-nitrophenyl)thiazole
CAS Number:
1188122-55-5
Molecular Formula:
C9H5ClN2O2S
Molecular Weight:
240.6662
MDL Number:
MFCD09746539
IUPAC Name:
2-chloro-4-(3-nitrophenyl)-1,3-thiazole
InChI:
InChI=1S/C9H5ClN2O2S/c10-9-11-8(5-15-9)6-2-1-3-7(4-6)12(13)14/h1-5H
InChI Key:
YKJLHPOQANIGHK-UHFFFAOYSA-N
SMILES:
Clc1scc(n1)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.976g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.661g/mol
Monoisotopic Mass:
239.976g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties