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159848-27-8 | 1-Hexanol, 5-methyl-2-propyl-
CAS No: 159848-27-8 Catalog No: AG001RGG MDL No:
Product Description
Catalog Number:
AG001RGG
Chemical Name:
1-Hexanol, 5-methyl-2-propyl-
CAS Number:
159848-27-8
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
IUPAC Name:
5-methyl-2-propylhexan-1-ol
InChI:
InChI=1S/C10H22O/c1-4-5-10(8-11)7-6-9(2)3/h9-11H,4-8H2,1-3H3
InChI Key:
QEVWDMOIPOLQBL-UHFFFAOYSA-N
SMILES:
CCCC(CCC(C)C)CO
Properties
Complexity:
78.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.167g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.285g/mol
Monoisotopic Mass:
158.167g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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