N-(2-bromo-5-methoxy-4-methylphenyl)prop-2-enamide

N-(2-bromo-5-methoxy-4-methylphenyl)prop-2-enamide

CAS: 2459725-65-4

Formula: C11H12BrNO2

SMILES: COC1=C(C)C=C(Br)C(NC(=O)C=C)=C1

IUPAC: N-(2-bromo-5-methoxy-4-methylphenyl)prop-2-enamide

InChI: InChI=1S/C11H12BrNO2/c1-4-11(14)13-9-6-10(15-3)7(2)5-8(9)12/h4-6H,1H2,2-3H3,(H,13,14)

Composition: C (48.91%), H (4.48%), Br (29.58%), N (5.19%), O (11.85%)

Molar Mass: 270.126

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	269.005142
Formal Charge	0
FSP3	0.18
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	LTSWQUCMHPPVBX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.7
Topological Polar Surface Area	38.33
Polarizability	23.91
Ring Count	1
Rotatable Bond Count	3

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