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7504-66-7 | 4-ALLYL-2-METHOXYPHENYL PROPIONATE
CAS No: 7504-66-7 Catalog No: AG005ENM MDL No:
Product Description
Catalog Number:
AG005ENM
Chemical Name:
4-ALLYL-2-METHOXYPHENYL PROPIONATE
CAS Number:
7504-66-7
Molecular Formula:
C13H16O3
Molecular Weight:
220.2643
IUPAC Name:
(2-methoxy-4-prop-2-enylphenyl) propanoate
InChI:
InChI=1S/C13H16O3/c1-4-6-10-7-8-11(12(9-10)15-3)16-13(14)5-2/h4,7-9H,1,5-6H2,2-3H3
InChI Key:
GZKIAPLXSBWPRY-UHFFFAOYSA-N
SMILES:
C=CCc1ccc(c(c1)OC)OC(=O)CC
EC Number:
231-357-2
NSC Number:
407878
Properties
Complexity:
237
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:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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