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101936-99-6 | 2-Propenoic acid, 3-phenyl-, 1-naphthalenyl ester
CAS No: 101936-99-6 Catalog No: AG00060K MDL No:
Product Description
Catalog Number:
AG00060K
Chemical Name:
2-Propenoic acid, 3-phenyl-, 1-naphthalenyl ester
CAS Number:
101936-99-6
Molecular Formula:
C19H14O2
Molecular Weight:
274.3133
IUPAC Name:
naphthalen-1-yl 3-phenylprop-2-enoate
InChI:
InChI=1S/C19H14O2/c20-19(14-13-15-7-2-1-3-8-15)21-18-12-6-10-16-9-4-5-11-17(16)18/h1-14H
InChI Key:
ILDQBAOOYYSRDQ-UHFFFAOYSA-N
SMILES:
O=C(Oc1cccc2c1cccc2)C=Cc1ccccc1
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.099g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.319g/mol
Monoisotopic Mass:
274.099g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.9
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