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69578-08-1 | 1,5-Hexadiene, 1-chloro-
CAS No: 69578-08-1 Catalog No: AG005K4G MDL No:
Product Description
Catalog Number:
AG005K4G
Chemical Name:
1,5-Hexadiene, 1-chloro-
CAS Number:
69578-08-1
Molecular Formula:
C6H9Cl
Molecular Weight:
116.5887
IUPAC Name:
1-chlorohexa-1,5-diene
InChI:
InChI=1S/C6H9Cl/c1-2-3-4-5-6-7/h2,5-6H,1,3-4H2
InChI Key:
YCLYFYFZLPMGPX-UHFFFAOYSA-N
SMILES:
C=CCCC=CCl
Properties
Complexity:
64.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.039g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
116.588g/mol
Monoisotopic Mass:
116.039g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.7
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