4-bromo-N-methoxy-N,2-dimethylbenzamide

4-bromo-N-methoxy-N,2-dimethylbenzamide

CAS: 178313-45-6

Formula: C10H12BrNO2

SMILES: CON(C)C(=O)C1=C(C)C=C(Br)C=C1

IUPAC: 4-bromo-N-methoxy-N,2-dimethylbenzamide

InChI: InChI=1S/C10H12BrNO2/c1-7-6-8(11)4-5-9(7)10(13)12(2)14-3/h4-6H,1-3H3

Composition: C (46.53%), H (4.69%), Br (30.96%), N (5.43%), O (12.40%)

Molar Mass: 258.115

Atom Count: 26

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	257.005142
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	MUTHMRPWEAXRML-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.94
Topological Polar Surface Area	29.54
Polarizability	22.16
Ring Count	1
Rotatable Bond Count	2

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