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1002-37-5 | 2-Hexyn-1-ol, 6-chloro-
CAS No: 1002-37-5 Catalog No: AG00018H MDL No:
Product Description
Catalog Number:
AG00018H
Chemical Name:
2-Hexyn-1-ol, 6-chloro-
CAS Number:
1002-37-5
Molecular Formula:
C6H9ClO
Molecular Weight:
132.5881
IUPAC Name:
6-chlorohex-2-yn-1-ol
InChI:
InChI=1S/C6H9ClO/c7-5-3-1-2-4-6-8/h8H,1,3,5-6H2
InChI Key:
RSZRMRUFASZUMS-UHFFFAOYSA-N
SMILES:
ClCCCC#CCO
Properties
Complexity:
97.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.034g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
132.587g/mol
Monoisotopic Mass:
132.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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