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57493-24-0 | 4-(3-Nitrophenyl)thiazol-2-amine
CAS No: 57493-24-0 Catalog No: AG003GE4 MDL No:MFCD00022455
Product Description
Catalog Number:
AG003GE4
Chemical Name:
4-(3-Nitrophenyl)thiazol-2-amine
CAS Number:
57493-24-0
Molecular Formula:
C9H7N3O2S
Molecular Weight:
221.2358
MDL Number:
MFCD00022455
IUPAC Name:
4-(3-nitrophenyl)-1,3-thiazol-2-amine
InChI:
InChI=1S/C9H7N3O2S/c10-9-11-8(5-15-9)6-2-1-3-7(4-6)12(13)14/h1-5H,(H2,10,11)
InChI Key:
CHBDOPARQRNCDM-UHFFFAOYSA-N
SMILES:
Nc1scc(n1)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.234g/mol
Monoisotopic Mass:
221.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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