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3096-97-7 | 2-Propenoic acid, 2-methyl-, 2-(phenylmethoxy)ethyl ester
CAS No: 3096-97-7 Catalog No: AG0031RV MDL No:
Product Description
Catalog Number:
AG0031RV
Chemical Name:
2-Propenoic acid, 2-methyl-, 2-(phenylmethoxy)ethyl ester
CAS Number:
3096-97-7
Molecular Formula:
C13H16O3
Molecular Weight:
220.2643
IUPAC Name:
2-phenylmethoxyethyl 2-methylprop-2-enoate
InChI:
InChI=1S/C13H16O3/c1-11(2)13(14)16-9-8-15-10-12-6-4-3-5-7-12/h3-7H,1,8-10H2,2H3
InChI Key:
CWVFILUMTNJKBN-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)OCCOCc1ccccc1
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.268g/mol
Monoisotopic Mass:
220.11g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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