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1400287-28-6 | Benzenamine, 2-chloro-4-(5-thiazolyl)-
CAS No: 1400287-28-6 Catalog No: AG001BYC MDL No:
Product Description
Catalog Number:
AG001BYC
Chemical Name:
Benzenamine, 2-chloro-4-(5-thiazolyl)-
CAS Number:
1400287-28-6
Molecular Formula:
C9H7ClN2S
Molecular Weight:
210.6833
IUPAC Name:
2-chloro-4-(1,3-thiazol-5-yl)aniline
InChI:
InChI=1S/C9H7ClN2S/c10-7-3-6(1-2-8(7)11)9-4-12-5-13-9/h1-5H,11H2
InChI Key:
YPJQAYAXHPRJBW-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1Cl)c1cncs1
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.002g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.679g/mol
Monoisotopic Mass:
210.002g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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