(Z)-3-methylpent-3-en-1-ol

C6H12O — CID 12576400

IUPAC(Z)-3-methylpent-3-en-1-ol
SMILESC/C=C(/C)CCO
InChIInChI=1S/C6H12O/c1-3-6(2)4-5-7/h3,7H,4-5H2,1-2H3/b6-3-
InChIKeySZPKMIRLEAFMBV-UTCJRWHESA-N
MW100.16 g/mol
LogP1.34
Rot. Bonds2

About (Z)-3-methylpent-3-en-1-ol

(Z)-3-methylpent-3-en-1-ol (PubChem CID 12576400) has the molecular formula C6H12O and a molecular weight of 100.16 g/mol. Its IUPAC name is (Z)-3-methylpent-3-en-1-ol.

Molecular Properties

Compound Name(Z)-3-methylpent-3-en-1-ol
PubChem CID12576400
Molecular FormulaC6H12O
Molecular Weight100.16 g/mol
Exact Mass100.09
IUPAC Name(Z)-3-methylpent-3-en-1-ol
SMILESC/C=C(/C)CCO
InChIInChI=1S/C6H12O/c1-3-6(2)4-5-7/h3,7H,4-5H2,1-2H3/b6-3-
InChIKeySZPKMIRLEAFMBV-UTCJRWHESA-N
XLogP1.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 51.34
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

(Z)-3-methylpent-2-ene-1,5-diol
CID 12561740
(Z)-3-methylhex-3-ene-1,6-diol
CID 129322397
CID 59448637
CID 59448637
3-methylhept-2-ene
CID 91513604
(E)-4-methylhex-4-en-1-amine
CID 55285525
(6E)-2,6-dimethylocta-2,6-diene
CID 5365898
5-methylhepta-1,5-diene
CID 54049787
(3E,5Z)-3-methylocta-3,5,7-trien-1-ol
CID 89264860
3,7-dimethylocta-3,6-diene-1,5-diol
CID 174979405
(E)-2,5-dimethylhept-5-en-2-ol
CID 10931542
(2Z,6E)-3,6-dimethylocta-2,6-dienal
CID 124647728
(E)-3-methyltridec-2-ene
CID 22000795

Frequently Asked Questions

What is the IUPAC name of (Z)-3-methylpent-3-en-1-ol?
The IUPAC name of (Z)-3-methylpent-3-en-1-ol (CID 12576400) is (Z)-3-methylpent-3-en-1-ol.
What is the SMILES notation for (Z)-3-methylpent-3-en-1-ol?
The canonical SMILES for (Z)-3-methylpent-3-en-1-ol is C/C=C(/C)CCO.
What is the InChIKey of (Z)-3-methylpent-3-en-1-ol?
The InChIKey is SZPKMIRLEAFMBV-UTCJRWHESA-N. The full InChI is InChI=1S/C6H12O/c1-3-6(2)4-5-7/h3,7H,4-5H2,1-2H3/b6-3-.
What are the key properties of (Z)-3-methylpent-3-en-1-ol?
(Z)-3-methylpent-3-en-1-ol has a molecular weight of 100.16 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-methylpent-3-en-1-ol is sourced from PubChem (CID 12576400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).