methyl 4-(bromomethyl)-2,5-dichlorobenzoate

methyl 4-(bromomethyl)-2,5-dichlorobenzoate

Formula: C9H7BrCl2O2

SMILES: COC(=O)C1=C(Cl)C=C(CBr)C(Cl)=C1

IUPAC: methyl 4-(bromomethyl)-2,5-dichlorobenzoate

InChI: InChI=1S/C9H7BrCl2O2/c1-14-9(13)6-3-7(11)5(4-10)2-8(6)12/h2-3H,4H2,1H3

Composition: C (36.28%), H (2.37%), Br (26.82%), Cl (23.80%), O (10.74%)

Molar Mass: 297.96

Atom Count: 21

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	295.900648
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	LTDBXDINOUYZHE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.54
Topological Polar Surface Area	26.3
Polarizability	23.32
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H7BrCl2O2		Quote Only