(Z)-5,5-dimethylhex-3-en-1-ol

C8H16O — CID 117268008

IUPAC(Z)-5,5-dimethylhex-3-en-1-ol
SMILESCC(C)(C)/C=C\CCO
InChIInChI=1S/C8H16O/c1-8(2,3)6-4-5-7-9/h4,6,9H,5,7H2,1-3H3/b6-4-
InChIKeyDCULKBZETKTADO-XQRVVYSFSA-N
MW128.21 g/mol
LogP1.97
Rot. Bonds2

About (Z)-5,5-dimethylhex-3-en-1-ol

(Z)-5,5-dimethylhex-3-en-1-ol (PubChem CID 117268008) has the molecular formula C8H16O and a molecular weight of 128.21 g/mol. Its IUPAC name is (Z)-5,5-dimethylhex-3-en-1-ol.

Molecular Properties

Compound Name(Z)-5,5-dimethylhex-3-en-1-ol
PubChem CID117268008
Molecular FormulaC8H16O
Molecular Weight128.21 g/mol
Exact Mass128.12
IUPAC Name(Z)-5,5-dimethylhex-3-en-1-ol
SMILESCC(C)(C)/C=C\CCO
InChIInChI=1S/C8H16O/c1-8(2,3)6-4-5-7-9/h4,6,9H,5,7H2,1-3H3/b6-4-
InChIKeyDCULKBZETKTADO-XQRVVYSFSA-N
XLogP1.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.21
LogP ≤ 51.97
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

(3E)-5,5-dimethylhepta-3,6-dien-1-ol
CID 10441786
(E)-2,2-dimethylhept-3-ene
CID 5352650
(E)-5,5,5-trifluoropent-3-en-1-ol
CID 20543344
14,14-dimethylpentadeca-4,8,12-trienoic acid
CID 141431302
(Z)-1-tert-butylsulfanyl-5,5-dimethylhex-3-ene
CID 58798569
1-bromo-4,4-dimethylpent-2-ene
CID 71373616
(E)-2,2-dimethylhex-3-ene
CID 5357261
13,13-dimethyltetradeca-3,7,11-trienamide
CID 154015526
12,12-dimethyltrideca-1,6,10-triene
CID 144926116
(Z)-5-pentyldec-3-ene-1,5-diol
CID 134895929
4,4-dimethylpent-2-enylboronic acid
CID 4185895
(2E)-6,6-dimethylhepta-2,4-dien-1-ol
CID 154163380

Frequently Asked Questions

What is the IUPAC name of (Z)-5,5-dimethylhex-3-en-1-ol?
The IUPAC name of (Z)-5,5-dimethylhex-3-en-1-ol (CID 117268008) is (Z)-5,5-dimethylhex-3-en-1-ol.
What is the SMILES notation for (Z)-5,5-dimethylhex-3-en-1-ol?
The canonical SMILES for (Z)-5,5-dimethylhex-3-en-1-ol is CC(C)(C)/C=C\CCO.
What is the InChIKey of (Z)-5,5-dimethylhex-3-en-1-ol?
The InChIKey is DCULKBZETKTADO-XQRVVYSFSA-N. The full InChI is InChI=1S/C8H16O/c1-8(2,3)6-4-5-7-9/h4,6,9H,5,7H2,1-3H3/b6-4-.
What are the key properties of (Z)-5,5-dimethylhex-3-en-1-ol?
(Z)-5,5-dimethylhex-3-en-1-ol has a molecular weight of 128.21 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5,5-dimethylhex-3-en-1-ol is sourced from PubChem (CID 117268008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).