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15971-31-0 | 2-Propenoic acid, 3-(4-methoxy-1-naphthalenyl)-, ethyl ester
CAS No: 15971-31-0 Catalog No: AG001RC2 MDL No:
Product Description
Catalog Number:
AG001RC2
Chemical Name:
2-Propenoic acid, 3-(4-methoxy-1-naphthalenyl)-, ethyl ester
CAS Number:
15971-31-0
Molecular Formula:
C16H16O3
Molecular Weight:
256.2964
IUPAC Name:
ethyl (E)-3-(4-methoxynaphthalen-1-yl)prop-2-enoate
InChI:
InChI=1S/C16H16O3/c1-3-19-16(17)11-9-12-8-10-15(18-2)14-7-5-4-6-13(12)14/h4-11H,3H2,1-2H3/b11-9+
InChI Key:
VBZWLZWCHZBRPA-PKNBQFBNSA-N
SMILES:
CCOC(=O)C=Cc1ccc(c2c1cccc2)OC
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
256.11g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.301g/mol
Monoisotopic Mass:
256.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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