5-methyl-1-phenylhexan-1-ol

C13H20O — CID 10997859

IUPAC5-methyl-1-phenylhexan-1-ol
SMILESCC(C)CCCC(O)c1ccccc1
InChIInChI=1S/C13H20O/c1-11(2)7-6-10-13(14)12-8-4-3-5-9-12/h3-5,8-9,11,13-14H,6-7,10H2,1-2H3
InChIKeyOVIHSMJIUIPZNM-UHFFFAOYSA-N
MW192.30 g/mol
LogP3.55
Rot. Bonds5

About 5-methyl-1-phenylhexan-1-ol

5-methyl-1-phenylhexan-1-ol (PubChem CID 10997859) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is 5-methyl-1-phenylhexan-1-ol.

Molecular Properties

Compound Name5-methyl-1-phenylhexan-1-ol
PubChem CID10997859
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name5-methyl-1-phenylhexan-1-ol
SMILESCC(C)CCCC(O)c1ccccc1
InChIInChI=1S/C13H20O/c1-11(2)7-6-10-13(14)12-8-4-3-5-9-12/h3-5,8-9,11,13-14H,6-7,10H2,1-2H3
InChIKeyOVIHSMJIUIPZNM-UHFFFAOYSA-N
XLogP3.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4R)-1-phenylpentane-1,4-diol
CID 13204353
(1S)-1-phenylpentan-1-ol
CID 6992754
1-(4-aminophenyl)-5-methylhexan-1-ol
CID 106695506
1-(4-chlorophenyl)-5-methylhexan-1-ol
CID 83158277
3-[methyl(2-methylpropyl)amino]-1-phenylpropan-1-ol
CID 62613916
(1R)-1-phenyloctan-1-ol
CID 12794259
(1R,5S)-1-phenyldecane-1,5-diol
CID 10879541
3-[2-methylpropyl(propan-2-yl)amino]-1-phenylpropan-1-ol
CID 62613763
1-methoxy-6-methyl-1-phenylheptan-2-ol
CID 116756994
1,4,4-triphenylbutan-1-ol
CID 141326006
1-phenylpropane-1,3-diol
CID 572059
5-chloro-1-phenylpentan-1-ol
CID 14449235

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-phenylhexan-1-ol?
The IUPAC name of 5-methyl-1-phenylhexan-1-ol (CID 10997859) is 5-methyl-1-phenylhexan-1-ol.
What is the SMILES notation for 5-methyl-1-phenylhexan-1-ol?
The canonical SMILES for 5-methyl-1-phenylhexan-1-ol is CC(C)CCCC(O)c1ccccc1.
What is the InChIKey of 5-methyl-1-phenylhexan-1-ol?
The InChIKey is OVIHSMJIUIPZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O/c1-11(2)7-6-10-13(14)12-8-4-3-5-9-12/h3-5,8-9,11,13-14H,6-7,10H2,1-2H3.
What are the key properties of 5-methyl-1-phenylhexan-1-ol?
5-methyl-1-phenylhexan-1-ol has a molecular weight of 192.30 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-phenylhexan-1-ol is sourced from PubChem (CID 10997859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).