1,4-dimethyl 2-(bromomethyl)benzene-1,4-dicarboxylate

1,4-dimethyl 2-(bromomethyl)benzene-1,4-dicarboxylate

CAS: 57834-13-6

Formula: C11H11BrO4

SMILES: COC(=O)C1=CC=C(C(=O)OC)C(CBr)=C1

IUPAC: 1,4-dimethyl 2-(bromomethyl)benzene-1,4-dicarboxylate

InChI: InChI=1S/C11H11BrO4/c1-15-10(13)7-3-4-9(11(14)16-2)8(5-7)6-12/h3-5H,6H2,1-2H3

Composition: C (46.02%), H (3.86%), Br (27.83%), O (22.29%)

Molar Mass: 287.109

Atom Count: 27

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	285.984072
Formal Charge	0
FSP3	0.27
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	UTIKNGRWJJKNBJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.96
Topological Polar Surface Area	52.6
Polarizability	23.87
Ring Count	1
Rotatable Bond Count	5

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97%	<2 Days	57834-13-6		$112.70-$1,029.25$112.70$141.45$151.80$189.75$258.75$1,029.25