N-(4-bromophenyl)-1,3-benzoxazol-2-amine

N-(4-bromophenyl)-1,3-benzoxazol-2-amine

CAS: 93186-69-7

Formula: C13H9BrN2O

SMILES: BrC1=CC=C(NC2=NC3=CC=CC=C3O2)C=C1

IUPAC: N-(4-bromophenyl)-1,3-benzoxazol-2-amine

InChI: InChI=1S/C13H9BrN2O/c14-9-5-7-10(8-6-9)15-13-16-11-3-1-2-4-12(11)17-13/h1-8H,(H,15,16)

Composition: C (54.00%), H (3.14%), Br (27.64%), N (9.69%), O (5.53%)

Molar Mass: 289.132

Atom Count: 26

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	287.989826
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PSSOLKKCZOLPGZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.31
Topological Polar Surface Area	38.06
Polarizability	27.25
Ring Count	3
Rotatable Bond Count	2

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