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119869-71-5

119869-71-5 | 1,4-Pentadien-3-one, 1,5-bis(3-chlorophenyl)-

CAS No: 119869-71-5 Catalog No: AG000PSR MDL No:

Product Description

Catalog Number:
AG000PSR
Chemical Name:
1,4-Pentadien-3-one, 1,5-bis(3-chlorophenyl)-
CAS Number:
119869-71-5
Molecular Formula:
C17H12Cl2O
Molecular Weight:
303.1826
IUPAC Name:
1,5-bis(3-chlorophenyl)penta-1,4-dien-3-one
InChI:
InChI=1S/C17H12Cl2O/c18-15-5-1-3-13(11-15)7-9-17(20)10-8-14-4-2-6-16(19)12-14/h1-12H
InChI Key:
AGUILNAYEDJFSM-UHFFFAOYSA-N
SMILES:
O=C(C=Cc1cccc(c1)Cl)C=Cc1cccc(c1)Cl

Properties

Complexity:
341  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.027g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.182g/mol
Monoisotopic Mass:
302.027g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2  
XLogP3:
5.4  

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