4-bromo-N-cyclohexyl-3-methoxybenzamide

4-bromo-N-cyclohexyl-3-methoxybenzamide

CAS: 1072944-40-1

Formula: C14H18BrNO2

SMILES: COC1=CC(=CC=C1Br)C(=O)NC1CCCCC1

IUPAC: 4-bromo-N-cyclohexyl-3-methoxybenzamide

InChI: InChI=1S/C14H18BrNO2/c1-18-13-9-10(7-8-12(13)15)14(17)16-11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,16,17)

Composition: C (53.86%), H (5.81%), Br (25.59%), N (4.49%), O (10.25%)

Molar Mass: 312.207

Atom Count: 36

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	311.052092
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YGGBJKQZGYGQQO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.13
Topological Polar Surface Area	38.33
Polarizability	28.79
Ring Count	2
Rotatable Bond Count	3

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