Home Halogens Methyl 3,4-bis(bromomethyl)benzoate

Methyl 3,4-bis(bromomethyl)benzoate

CAS No.:
20896-23-5
Catalog Number:
AG002JZJ
Molecular Formula:
C10H10Br2O2
Molecular Weight:
321.9932
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Product Description
Catalog Number:
AG002JZJ
Chemical Name:
Methyl 3,4-bis(bromomethyl)benzoate
CAS Number:
20896-23-5
Molecular Formula:
C10H10Br2O2
Molecular Weight:
321.9932
MDL Number:
MFCD00219865
IUPAC Name:
methyl 3,4-bis(bromomethyl)benzoate
InChI:
InChI=1S/C10H10Br2O2/c1-14-10(13)7-2-3-8(5-11)9(4-7)6-12/h2-4H,5-6H2,1H3
InChI Key:
PZOQMRZOUBBQFO-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)CBr)CBr
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.903g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.996g/mol
Monoisotopic Mass:
319.905g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties