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148433-11-8 | 2-Propenoic acid, 3-(4-propoxyphenyl)-, ethyl ester
CAS No: 148433-11-8 Catalog No: AG001KWZ MDL No:
Product Description
Catalog Number:
AG001KWZ
Chemical Name:
2-Propenoic acid, 3-(4-propoxyphenyl)-, ethyl ester
CAS Number:
148433-11-8
Molecular Formula:
C14H18O3
Molecular Weight:
234.2909
IUPAC Name:
ethyl 3-(4-propoxyphenyl)prop-2-enoate
InChI:
InChI=1S/C14H18O3/c1-3-11-17-13-8-5-12(6-9-13)7-10-14(15)16-4-2/h5-10H,3-4,11H2,1-2H3
InChI Key:
NBAKBANEYSHFOI-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1)C=CC(=O)OCC
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.295g/mol
Monoisotopic Mass:
234.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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