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80687-05-4

80687-05-4 | 2-Propen-1-one, 1-(2-hydroxyphenyl)-3-(1-naphthalenyl)-

CAS No: 80687-05-4 Catalog No: AG005JXO MDL No:

Product Description

Catalog Number:
AG005JXO
Chemical Name:
2-Propen-1-one, 1-(2-hydroxyphenyl)-3-(1-naphthalenyl)-
CAS Number:
80687-05-4
Molecular Formula:
C19H14O2
Molecular Weight:
274.3133
IUPAC Name:
1-(2-hydroxyphenyl)-3-naphthalen-1-ylprop-2-en-1-one
InChI:
InChI=1S/C19H14O2/c20-18-11-4-3-10-17(18)19(21)13-12-15-8-5-7-14-6-1-2-9-16(14)15/h1-13,20H
InChI Key:
KRWCRUXGJDMVIY-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1O)C=Cc1cccc2c1cccc2

Properties

Complexity:
387  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
274.319g/mol
Monoisotopic Mass:
274.099g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.1  

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