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2138236-02-7 | 3-(1,2-oxazol-3-yl)aniline hydrochloride
CAS No: 2138236-02-7 Catalog No: AG01EI83 MDL No:MFCD31435819
Product Description
Catalog Number:
AG01EI83
Chemical Name:
3-(1,2-oxazol-3-yl)aniline hydrochloride
CAS Number:
2138236-02-7
Molecular Formula:
C9H9ClN2O
Molecular Weight:
196.6336
MDL Number:
MFCD31435819
IUPAC Name:
3-(1,2-oxazol-3-yl)aniline;hydrochloride
InChI:
InChI=1S/C9H8N2O.ClH/c10-8-3-1-2-7(6-8)9-4-5-12-11-9;/h1-6H,10H2;1H
InChI Key:
RJOJPVBFCHKUEJ-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)c1nocc1.Cl
Properties
Complexity:
152
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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