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137580-96-2

137580-96-2 | 2-Propen-1-one, 1-(4-ethylphenyl)-3-(4-hydroxyphenyl)-

CAS No: 137580-96-2 Catalog No: AG0013L6 MDL No:

Product Description

Catalog Number:
AG0013L6
Chemical Name:
2-Propen-1-one, 1-(4-ethylphenyl)-3-(4-hydroxyphenyl)-
CAS Number:
137580-96-2
Molecular Formula:
C17H16O2
Molecular Weight:
252.3077
IUPAC Name:
1-(4-ethylphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
InChI:
InChI=1S/C17H16O2/c1-2-13-3-8-15(9-4-13)17(19)12-7-14-5-10-16(18)11-6-14/h3-12,18H,2H2,1H3
InChI Key:
YIJNRSLUKBTIEM-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)C(=O)C=Cc1ccc(cc1)O

Properties

Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.115g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
252.313g/mol
Monoisotopic Mass:
252.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.5  

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