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15854-56-5 | 2-Propenoic acid, 3-(3-methoxyphenyl)-, methyl ester
CAS No: 15854-56-5 Catalog No: AG001QAQ MDL No:
Product Description
Catalog Number:
AG001QAQ
Chemical Name:
2-Propenoic acid, 3-(3-methoxyphenyl)-, methyl ester
CAS Number:
15854-56-5
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
IUPAC Name:
methyl (E)-3-(3-methoxyphenyl)prop-2-enoate
InChI:
InChI=1S/C11H12O3/c1-13-10-5-3-4-9(8-10)6-7-11(12)14-2/h3-8H,1-2H3/b7-6+
InChI Key:
NDMAAKFMVKZYIV-VOTSOKGWSA-N
SMILES:
COC(=O)C=Cc1cccc(c1)OC
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
192.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.214g/mol
Monoisotopic Mass:
192.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| Phenylcinnamides as novel antimitotic agents. | Journal of medicinal chemistry 20100527 |
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