Home Halogens Methyl 3-bromo-2,4-dimethylbenzoate

Methyl 3-bromo-2,4-dimethylbenzoate

CAS No.:
151859-37-9
Catalog Number:
AG00HXX1
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$177
- +
1g
95%
1 week
United States
$385
- +
Product Description
Catalog Number:
AG00HXX1
Chemical Name:
Methyl 3-bromo-2,4-dimethylbenzoate
CAS Number:
151859-37-9
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
MDL Number:
MFCD22570370
IUPAC Name:
methyl 3-bromo-2,4-dimethylbenzoate
InChI:
InChI=1S/C10H11BrO2/c1-6-4-5-8(10(12)13-3)7(2)9(6)11/h4-5H,1-3H3
InChI Key:
BDSPQXLUCOPAHB-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1C)Br)C
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.994g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.1g/mol
Monoisotopic Mass:
241.994g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties