200,000+ products from a single source!
sales@angenechem.com
13012-94-7 | Acetic acid, 2-(3,5-dibromo-4-hydroxyphenoxy)-
CAS No: 13012-94-7 Catalog No: AG000U1F MDL No:
Product Description
Catalog Number:
AG000U1F
Chemical Name:
Acetic acid, 2-(3,5-dibromo-4-hydroxyphenoxy)-
CAS Number:
13012-94-7
Molecular Formula:
C8H6Br2O4
Molecular Weight:
325.9388
IUPAC Name:
2-(3,5-dibromo-4-hydroxyphenoxy)acetic acid
InChI:
InChI=1S/C8H6Br2O4/c9-5-1-4(14-3-7(11)12)2-6(10)8(5)13/h1-2,13H,3H2,(H,11,12)
InChI Key:
QGTZHPLLOLDFON-UHFFFAOYSA-N
SMILES:
OC(=O)COc1cc(Br)c(c(c1)Br)O
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.861g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
325.94g/mol
Monoisotopic Mass:
323.863g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.