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821794-58-5 | 2-Propenoic acid, 1-(8-hydroxy-1-naphthalenyl)ethyl ester
CAS No: 821794-58-5 Catalog No: AG00575H MDL No:
Product Description
Catalog Number:
AG00575H
Chemical Name:
2-Propenoic acid, 1-(8-hydroxy-1-naphthalenyl)ethyl ester
CAS Number:
821794-58-5
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
IUPAC Name:
1-(8-hydroxynaphthalen-1-yl)ethyl prop-2-enoate
InChI:
InChI=1S/C15H14O3/c1-3-14(17)18-10(2)12-8-4-6-11-7-5-9-13(16)15(11)12/h3-10,16H,1H2,2H3
InChI Key:
ASEAXQDVEOMAGK-UHFFFAOYSA-N
SMILES:
C=CC(=O)OC(c1cccc2c1c(O)ccc2)C
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.094g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.274g/mol
Monoisotopic Mass:
242.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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