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114534-22-4 | 6-Hepten-4-yn-3-ol, 7-chloro-, (Z)- (9CI)
CAS No: 114534-22-4 Catalog No: AG000ENQ MDL No:
Product Description
Catalog Number:
AG000ENQ
Chemical Name:
6-Hepten-4-yn-3-ol, 7-chloro-, (Z)- (9CI)
CAS Number:
114534-22-4
Molecular Formula:
C7H9ClO
Molecular Weight:
144.5988
IUPAC Name:
7-chlorohept-6-en-4-yn-3-ol
InChI:
InChI=1S/C7H9ClO/c1-2-7(9)5-3-4-6-8/h4,6-7,9H,2H2,1H3
InChI Key:
GICSTXSPYBBMNX-UHFFFAOYSA-N
SMILES:
Cl/C=C\C#CC(CC)O
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.034g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.598g/mol
Monoisotopic Mass:
144.034g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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