Home Halogens Methyl 3-bromo-4-cyclopropylbenzoate

Methyl 3-bromo-4-cyclopropylbenzoate

CAS No.:
1131615-05-8
Catalog Number:
AG003RRF
Molecular Formula:
C11H11BrO2
Molecular Weight:
255.1078
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Product Description
Catalog Number:
AG003RRF
Chemical Name:
Methyl 3-bromo-4-cyclopropylbenzoate
CAS Number:
1131615-05-8
Molecular Formula:
C11H11BrO2
Molecular Weight:
255.1078
MDL Number:
MFCD11112993
IUPAC Name:
methyl 3-bromo-4-cyclopropylbenzoate
InChI:
InChI=1S/C11H11BrO2/c1-14-11(13)8-4-5-9(7-2-3-7)10(12)6-8/h4-7H,2-3H2,1H3
InChI Key:
GZRJNRGOVPQPIP-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)Br)C1CC1
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.994g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.111g/mol
Monoisotopic Mass:
253.994g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties