200,000+ products from a single source!
sales@angenechem.com
860771-95-5 | methyl 2-(3-bromophenyl)-2-hydroxyacetate
CAS No: 860771-95-5 Catalog No: AG01FBQO MDL No:
Product Description
Catalog Number:
AG01FBQO
Chemical Name:
methyl 2-(3-bromophenyl)-2-hydroxyacetate
CAS Number:
860771-95-5
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
IUPAC Name:
methyl 2-(3-bromophenyl)-2-hydroxyacetate
InChI:
InChI=1S/C9H9BrO3/c1-13-9(12)8(11)6-3-2-4-7(10)5-6/h2-5,8,11H,1H3
InChI Key:
CYNXNJIDHSYRQP-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1cccc(c1)Br)O
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.974g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.072g/mol
Monoisotopic Mass:
243.974g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.