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20767-04-8 | 2-Propenoic acid, 3-(3,5-dimethoxyphenyl)-, (2E)-
CAS No: 20767-04-8 Catalog No: AG002J7N MDL No:
Product Description
Catalog Number:
AG002J7N
Chemical Name:
2-Propenoic acid, 3-(3,5-dimethoxyphenyl)-, (2E)-
CAS Number:
20767-04-8
Molecular Formula:
C11H12O4
Molecular Weight:
208.2106
IUPAC Name:
3-(3,5-dimethoxyphenyl)prop-2-enoic acid
InChI:
InChI=1S/C11H12O4/c1-14-9-5-8(3-4-11(12)13)6-10(7-9)15-2/h3-7H,1-2H3,(H,12,13)
InChI Key:
VLSRUFWCGBMYDJ-UHFFFAOYSA-N
SMILES:
COc1cc(/C=C/C(=O)O)cc(c1)OC
EC Number:
240-956-8
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.213g/mol
Monoisotopic Mass:
208.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| (E)-3-(3,5-Dimethoxy-phen-yl)acrylo-hydrazide. | Acta crystallographica. Section E, Structure reports online 20081001 |
| Seed dressings to control slug damage in oilseed rape. | Pest management science 20020701 |
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