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2137767-11-2 | 4-(1,2-oxazol-3-yl)aniline hydrochloride
CAS No: 2137767-11-2 Catalog No: AG01EI72 MDL No:MFCD31435820
Product Description
Catalog Number:
AG01EI72
Chemical Name:
4-(1,2-oxazol-3-yl)aniline hydrochloride
CAS Number:
2137767-11-2
Molecular Formula:
C9H9ClN2O
Molecular Weight:
196.6336
MDL Number:
MFCD31435820
IUPAC Name:
4-(1,2-oxazol-3-yl)aniline;hydrochloride
InChI:
InChI=1S/C9H8N2O.ClH/c10-8-3-1-7(2-4-8)9-5-6-12-11-9;/h1-6H,10H2;1H
InChI Key:
IRJGMVMUGXQHRW-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1ccon1.Cl
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.04g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.634g/mol
Monoisotopic Mass:
196.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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