3-(4-bromophenyl)-1,2-oxazol-5-amine

3-(4-bromophenyl)-1,2-oxazol-5-amine

CAS: 119162-53-7

Formula: C9H7BrN2O

SMILES: NC1=CC(=NO1)C1=CC=C(Br)C=C1

IUPAC: 3-(4-bromophenyl)-1,2-oxazol-5-amine

InChI: InChI=1S/C9H7BrN2O/c10-7-3-1-6(2-4-7)8-5-9(11)13-12-8/h1-5H,11H2

Composition: C (45.22%), H (2.95%), Br (33.42%), N (11.72%), O (6.69%)

Molar Mass: 239.072

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	237.974176
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	RKWRDXQHQYRFCX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.84
Topological Polar Surface Area	52.05
Polarizability	21.15
Ring Count	2
Rotatable Bond Count	1

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Struchem co.,ltd

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