2-methyl-6-phenylhex-1-en-3-ol

C13H18O — CID 23207508

IUPAC2-methyl-6-phenylhex-1-en-3-ol
SMILESC=C(C)C(O)CCCc1ccccc1
InChIInChI=1S/C13H18O/c1-11(2)13(14)10-6-9-12-7-4-3-5-8-12/h3-5,7-8,13-14H,1,6,9-10H2,2H3
InChIKeyWSYKWFBPZMIGIA-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.95
Rot. Bonds5

About 2-methyl-6-phenylhex-1-en-3-ol

2-methyl-6-phenylhex-1-en-3-ol (PubChem CID 23207508) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-methyl-6-phenylhex-1-en-3-ol.

Molecular Properties

Compound Name2-methyl-6-phenylhex-1-en-3-ol
PubChem CID23207508
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name2-methyl-6-phenylhex-1-en-3-ol
SMILESC=C(C)C(O)CCCc1ccccc1
InChIInChI=1S/C13H18O/c1-11(2)13(14)10-6-9-12-7-4-3-5-8-12/h3-5,7-8,13-14H,1,6,9-10H2,2H3
InChIKeyWSYKWFBPZMIGIA-UHFFFAOYSA-N
XLogP2.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

6-(furan-3-yl)-2-methylhex-1-en-3-ol
CID 121218914
2-[(2R)-2-hydroxy-3-methylbut-3-enyl]-5-(2-phenylethyl)benzene-1,3-diol
CID 163016308
3-methyl-6-phenylhexan-2-ol
CID 54498182
2-methyl-7-phenylhept-2-en-4-ol
CID 71663928
15-phenylpentadecane-1,1-diol
CID 139927269
2-methyl-5-(4-methylphenyl)pent-1-en-3-ol
CID 105110468
(4S)-4-hydroxy-3-methylidene-6-phenylhexan-2-one
CID 100977771
(2R)-5-phenylpentane-1,2-diol
CID 102483629
6-phenyl-3-propan-2-ylhexan-2-ol
CID 62914612
2-methyl-7-phenylheptane-3,4-diol
CID 103456597
3-methyl-6-phenylhexan-2-one
CID 59396975
(3-ethyl-4-methylpent-4-enyl)benzene
CID 123220776

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-phenylhex-1-en-3-ol?
The IUPAC name of 2-methyl-6-phenylhex-1-en-3-ol (CID 23207508) is 2-methyl-6-phenylhex-1-en-3-ol.
What is the SMILES notation for 2-methyl-6-phenylhex-1-en-3-ol?
The canonical SMILES for 2-methyl-6-phenylhex-1-en-3-ol is C=C(C)C(O)CCCc1ccccc1.
What is the InChIKey of 2-methyl-6-phenylhex-1-en-3-ol?
The InChIKey is WSYKWFBPZMIGIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O/c1-11(2)13(14)10-6-9-12-7-4-3-5-8-12/h3-5,7-8,13-14H,1,6,9-10H2,2H3.
What are the key properties of 2-methyl-6-phenylhex-1-en-3-ol?
2-methyl-6-phenylhex-1-en-3-ol has a molecular weight of 190.29 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-phenylhex-1-en-3-ol is sourced from PubChem (CID 23207508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).