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189620-97-1 | Benzoic acid, 2-(2-hydroxyethoxy)-, 2-hydroxyethyl ester
CAS No: 189620-97-1 Catalog No: AG002DSL MDL No:
Product Description
Catalog Number:
AG002DSL
Chemical Name:
Benzoic acid, 2-(2-hydroxyethoxy)-, 2-hydroxyethyl ester
CAS Number:
189620-97-1
Molecular Formula:
C11H14O5
Molecular Weight:
226.2259
IUPAC Name:
2-hydroxyethyl 2-(2-hydroxyethoxy)benzoate
InChI:
InChI=1S/C11H14O5/c12-5-7-15-10-4-2-1-3-9(10)11(14)16-8-6-13/h1-4,12-13H,5-8H2
InChI Key:
CXTCKQKTCLZXDL-UHFFFAOYSA-N
SMILES:
OCCOC(=O)c1ccccc1OCCO
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.084g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
226.228g/mol
Monoisotopic Mass:
226.084g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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