200,000+ products from a single source!
sales@angenechem.com
119515-19-4 | Benzoic acid, 3,6-dichloro-2-methoxy-, 1-carboxyethyl ester
CAS No: 119515-19-4 Catalog No: AG000IX3 MDL No:
Product Description
Catalog Number:
AG000IX3
Chemical Name:
Benzoic acid, 3,6-dichloro-2-methoxy-, 1-carboxyethyl ester
CAS Number:
119515-19-4
Molecular Formula:
C11H10Cl2O5
Molecular Weight:
293.1001
IUPAC Name:
2-(3,6-dichloro-2-methoxybenzoyl)oxypropanoic acid
InChI:
InChI=1S/C11H10Cl2O5/c1-5(10(14)15)18-11(16)8-6(12)3-4-7(13)9(8)17-2/h3-5H,1-2H3,(H,14,15)
InChI Key:
NRJOZZLAKKFHFQ-UHFFFAOYSA-N
SMILES:
COc1c(Cl)ccc(c1C(=O)OC(C(=O)O)C)Cl
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.991g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.096g/mol
Monoisotopic Mass:
291.991g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.