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175552-86-0

175552-86-0 | 2,4,6-Heptatrienoyl chloride, 7-cyclohexyl-, (2E,4E,6E)-

CAS No: 175552-86-0 Catalog No: AG00210Z MDL No:

Product Description

Catalog Number:
AG00210Z
Chemical Name:
2,4,6-Heptatrienoyl chloride, 7-cyclohexyl-, (2E,4E,6E)-
CAS Number:
175552-86-0
Molecular Formula:
C13H17ClO
Molecular Weight:
224.7265
IUPAC Name:
7-cyclohexylhepta-2,4,6-trienoyl chloride
InChI:
InChI=1S/C13H17ClO/c14-13(15)11-7-2-1-4-8-12-9-5-3-6-10-12/h1-2,4,7-8,11-12H,3,5-6,9-10H2
InChI Key:
ILPCTZUZMIRUSF-UHFFFAOYSA-N
SMILES:
ClC(=O)/C=C/C=C/C=C/C1CCCCC1

Properties

Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.097g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.728g/mol
Monoisotopic Mass:
224.097g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3  
XLogP3:
5.1  

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