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88465-95-6 | 2-Propenoic acid, 2-(2-phenylethoxy)ethyl ester
CAS No: 88465-95-6 Catalog No: AG004C8K MDL No:
Product Description
Catalog Number:
AG004C8K
Chemical Name:
2-Propenoic acid, 2-(2-phenylethoxy)ethyl ester
CAS Number:
88465-95-6
Molecular Formula:
C13H16O3
Molecular Weight:
220.2643
IUPAC Name:
2-(2-phenylethoxy)ethyl prop-2-enoate
InChI:
InChI=1S/C13H16O3/c1-2-13(14)16-11-10-15-9-8-12-6-4-3-5-7-12/h2-7H,1,8-11H2
InChI Key:
URFZHMKEGXLPDV-UHFFFAOYSA-N
SMILES:
C=CC(=O)OCCOCCc1ccccc1
Properties
Complexity:
207
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:
8
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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