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88702-52-7

88702-52-7 | 3-Penten-2-one, 4-(4-chlorophenyl)-, (E)-

CAS No: 88702-52-7 Catalog No: AG0046GV MDL No:

Product Description

Catalog Number:
AG0046GV
Chemical Name:
3-Penten-2-one, 4-(4-chlorophenyl)-, (E)-
CAS Number:
88702-52-7
Molecular Formula:
C11H11ClO
Molecular Weight:
194.6574
IUPAC Name:
4-(4-chlorophenyl)pent-3-en-2-one
InChI:
InChI=1S/C11H11ClO/c1-8(7-9(2)13)10-3-5-11(12)6-4-10/h3-7H,1-2H3
InChI Key:
VZBPTUDNQNQCKV-UHFFFAOYSA-N
SMILES:
C/C(=C\C(=O)C)/c1ccc(cc1)Cl

Properties

Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.05g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.658g/mol
Monoisotopic Mass:
194.05g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.3  

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