200,000+ products from a single source!
sales@angenechem.com
101460-22-4 | Benzoic acid, 3-bromo-2,5,6-trimethoxy-
CAS No: 101460-22-4 Catalog No: AG0004IV MDL No:MFCD00191620
Product Description
Catalog Number:
AG0004IV
Chemical Name:
Benzoic acid, 3-bromo-2,5,6-trimethoxy-
CAS Number:
101460-22-4
Molecular Formula:
C10H11BrO5
Molecular Weight:
291.0953
MDL Number:
MFCD00191620
IUPAC Name:
3-bromo-2,5,6-trimethoxybenzoic acid
InChI:
InChI=1S/C10H11BrO5/c1-14-6-4-5(11)8(15-2)7(10(12)13)9(6)16-3/h4H,1-3H3,(H,12,13)
InChI Key:
YHDRAWVCUZZYCU-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c(c(c1OC)C(=O)O)OC
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.979g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.097g/mol
Monoisotopic Mass:
289.979g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.