200,000+ products from a single source!
sales@angenechem.com
87995-48-0 | Propanoic acid, 2,2-dimethyl-, 2-bromo-4-methylphenyl ester
CAS No: 87995-48-0 Catalog No: AG004O7L MDL No:
Product Description
Catalog Number:
AG004O7L
Chemical Name:
Propanoic acid, 2,2-dimethyl-, 2-bromo-4-methylphenyl ester
CAS Number:
87995-48-0
Molecular Formula:
C12H15BrO2
Molecular Weight:
271.1503
IUPAC Name:
(2-bromo-4-methylphenyl) 2,2-dimethylpropanoate
InChI:
InChI=1S/C12H15BrO2/c1-8-5-6-10(9(13)7-8)15-11(14)12(2,3)4/h5-7H,1-4H3
InChI Key:
JHXCATMUUUWEML-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)Br)OC(=O)C(C)(C)C
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.154g/mol
Monoisotopic Mass:
270.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.