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14778-47-3 | 2-Propenoic acid, 2-methyl-, 2-(benzoyloxy)ethyl ester
CAS No: 14778-47-3 Catalog No: AG001F7P MDL No:
Product Description
Catalog Number:
AG001F7P
Chemical Name:
2-Propenoic acid, 2-methyl-, 2-(benzoyloxy)ethyl ester
CAS Number:
14778-47-3
Molecular Formula:
C13H14O4
Molecular Weight:
234.2479
IUPAC Name:
2-(2-methylprop-2-enoyloxy)ethyl benzoate
InChI:
InChI=1S/C13H14O4/c1-10(2)12(14)16-8-9-17-13(15)11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3
InChI Key:
IRUHNBOMXBGOGR-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)OCCOC(=O)C(=C)C
EC Number:
238-844-9
Properties
Complexity:
290
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:
0
Isotope Atom Count:
0
Molecular Weight:
234.251g/mol
Monoisotopic Mass:
234.089g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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