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19152-48-8

19152-48-8 | 2-Propen-1-one, 1-[4-(oxiranylmethoxy)phenyl]-3-phenyl- (9CI)

CAS No: 19152-48-8 Catalog No: AG002FA0 MDL No:

Product Description

Catalog Number:
AG002FA0
Chemical Name:
2-Propen-1-one, 1-[4-(oxiranylmethoxy)phenyl]-3-phenyl- (9CI)
CAS Number:
19152-48-8
Molecular Formula:
C18H16O3
Molecular Weight:
280.3178
IUPAC Name:
1-[4-(oxiran-2-ylmethoxy)phenyl]-3-phenylprop-2-en-1-one
InChI:
InChI=1S/C18H16O3/c19-18(11-6-14-4-2-1-3-5-14)15-7-9-16(10-8-15)20-12-17-13-21-17/h1-11,17H,12-13H2
InChI Key:
ZHRJQHWCLNECDL-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)OCC1OC1)C=Cc1ccccc1

Properties

Complexity:
363  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.11g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.323g/mol
Monoisotopic Mass:
280.11g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.4  

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