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18804-33-6 | 2-Hexanol, 6-chloro-
CAS No: 18804-33-6 Catalog No: AG002GOA MDL No:
Product Description
Catalog Number:
AG002GOA
Chemical Name:
2-Hexanol, 6-chloro-
CAS Number:
18804-33-6
Molecular Formula:
C6H13ClO
Molecular Weight:
136.6198
IUPAC Name:
6-chlorohexan-2-ol
InChI:
InChI=1S/C6H13ClO/c1-6(8)4-2-3-5-7/h6,8H,2-5H2,1H3
InChI Key:
LDIPECSHAACCTQ-UHFFFAOYSA-N
SMILES:
ClCCCCC(O)C
Properties
Complexity:
47.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.065g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
136.619g/mol
Monoisotopic Mass:
136.065g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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