4-(1,3-benzoxazol-2-yl)-2-methylaniline

4-(1,3-benzoxazol-2-yl)-2-methylaniline

CAS: 792946-65-7

Formula: C14H12N2O

SMILES: CC1=C(N)C=CC(=C1)C1=NC2=CC=CC=C2O1

IUPAC: 4-(1,3-benzoxazol-2-yl)-2-methylaniline

InChI: InChI=1S/C14H12N2O/c1-9-8-10(6-7-11(9)15)14-16-12-4-2-3-5-13(12)17-14/h2-8H,15H2,1H3

Composition: C (74.98%), H (5.39%), N (12.49%), O (7.13%)

Molar Mass: 224.263

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	224.094963014
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ABVMKKSXLVXFQL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.57
Topological Polar Surface Area	52.05
Polarizability	27.07
Ring Count	3
Rotatable Bond Count	1

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