(E)-6-(4-methylphenyl)hex-5-en-1-ol

C13H18O — CID 14739740

IUPAC(E)-6-(4-methylphenyl)hex-5-en-1-ol
SMILESCc1ccc(/C=C/CCCCO)cc1
InChIInChI=1S/C13H18O/c1-12-7-9-13(10-8-12)6-4-2-3-5-11-14/h4,6-10,14H,2-3,5,11H2,1H3/b6-4+
InChIKeyPKCHVAQGRBCHCY-GQCTYLIASA-N
MW190.29 g/mol
LogP3.17
Rot. Bonds5

About (E)-6-(4-methylphenyl)hex-5-en-1-ol

(E)-6-(4-methylphenyl)hex-5-en-1-ol (PubChem CID 14739740) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is (E)-6-(4-methylphenyl)hex-5-en-1-ol.

Molecular Properties

Compound Name(E)-6-(4-methylphenyl)hex-5-en-1-ol
PubChem CID14739740
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name(E)-6-(4-methylphenyl)hex-5-en-1-ol
SMILESCc1ccc(/C=C/CCCCO)cc1
InChIInChI=1S/C13H18O/c1-12-7-9-13(10-8-12)6-4-2-3-5-11-14/h4,6-10,14H,2-3,5,11H2,1H3/b6-4+
InChIKeyPKCHVAQGRBCHCY-GQCTYLIASA-N
XLogP3.17
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 ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-9-phenylnon-8-en-1-ol
CID 10489025
methyl 4-(6-hydroxyhex-1-enyl)benzoate
CID 67163381
(E)-5-(4-bromophenyl)pent-4-en-1-ol
CID 125476548
methyl (E)-12-(4-methylphenyl)dodec-11-enoate
CID 169218729
4-(4-methylphenyl)but-3-ene-1-thiol
CID 170477722
5-(4-methylphenyl)pent-4-enal
CID 85344490
5-(4-methylphenyl)pent-4-enenitrile
CID 174636399
1-methyl-4-[(Z)-5-(2-propylphenyl)pent-1-enyl]benzene
CID 142863046
(E)-6-(3-methoxyphenyl)hex-5-en-1-ol
CID 14739737
tert-butyl 2-[7-(4-methylphenyl)hept-6-enoxy]acetate
CID 139655818
1-[(Z)-hept-1-enyl]-4-methoxybenzene;1-iodo-4-methylbenzene
CID 159696317
4-[(E)-non-1-enyl]benzoic acid
CID 19834795

Frequently Asked Questions

What is the IUPAC name of (E)-6-(4-methylphenyl)hex-5-en-1-ol?
The IUPAC name of (E)-6-(4-methylphenyl)hex-5-en-1-ol (CID 14739740) is (E)-6-(4-methylphenyl)hex-5-en-1-ol.
What is the SMILES notation for (E)-6-(4-methylphenyl)hex-5-en-1-ol?
The canonical SMILES for (E)-6-(4-methylphenyl)hex-5-en-1-ol is Cc1ccc(/C=C/CCCCO)cc1.
What is the InChIKey of (E)-6-(4-methylphenyl)hex-5-en-1-ol?
The InChIKey is PKCHVAQGRBCHCY-GQCTYLIASA-N. The full InChI is InChI=1S/C13H18O/c1-12-7-9-13(10-8-12)6-4-2-3-5-11-14/h4,6-10,14H,2-3,5,11H2,1H3/b6-4+.
What are the key properties of (E)-6-(4-methylphenyl)hex-5-en-1-ol?
(E)-6-(4-methylphenyl)hex-5-en-1-ol has a molecular weight of 190.29 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-6-(4-methylphenyl)hex-5-en-1-ol is sourced from PubChem (CID 14739740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).