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904086-00-6 | 3-(1,2-thiazol-5-yl)aniline
CAS No: 904086-00-6 Catalog No: AG00IG4S MDL No:
Product Description
Catalog Number:
AG00IG4S
Chemical Name:
3-(1,2-thiazol-5-yl)aniline
CAS Number:
904086-00-6
IUPAC Name:
3-(1,2-thiazol-5-yl)aniline
InChI:
InChI=1S/C9H8N2S/c10-8-3-1-2-7(6-8)9-4-5-11-12-9/h1-6H,10H2
InChI Key:
VIVGZELEQSMMCF-UHFFFAOYSA-N
Properties
Complexity:
152
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:
2
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