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193017-26-4 | 4-(1,3-THIAZOL-2-YL)ANILINE
CAS No: 193017-26-4 Catalog No: AG00ACB9 MDL No:MFCD06655097
Product Description
Catalog Number:
AG00ACB9
Chemical Name:
4-(1,3-THIAZOL-2-YL)ANILINE
CAS Number:
193017-26-4
Molecular Formula:
C9H8N2S
Molecular Weight:
176.2382
MDL Number:
MFCD06655097
IUPAC Name:
4-(1,3-thiazol-2-yl)aniline
InChI:
InChI=1S/C9H8N2S/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-6H,10H2
InChI Key:
ZGOFHPZQYOXFCP-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1nccs1
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.041g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.237g/mol
Monoisotopic Mass:
176.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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