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84213-07-0 | Benzoic acid, 2-hydroxy-5-(2-propenyloxy)-, 2-propenyl ester
CAS No: 84213-07-0 Catalog No: AG004RWI MDL No:
Product Description
Catalog Number:
AG004RWI
Chemical Name:
Benzoic acid, 2-hydroxy-5-(2-propenyloxy)-, 2-propenyl ester
CAS Number:
84213-07-0
Molecular Formula:
C13H14O4
Molecular Weight:
234.2479
IUPAC Name:
prop-2-enyl 2-hydroxy-5-prop-2-enoxybenzoate
InChI:
InChI=1S/C13H14O4/c1-3-7-16-10-5-6-12(14)11(9-10)13(15)17-8-4-2/h3-6,9,14H,1-2,7-8H2
InChI Key:
NXBBLHXAUQCTPD-UHFFFAOYSA-N
SMILES:
C=CCOc1ccc(c(c1)C(=O)OCC=C)O
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.089g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.251g/mol
Monoisotopic Mass:
234.089g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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