(5Z)-4-methylideneocta-5,7-dien-3-ol

C9H14O — CID 143759474

IUPAC(5Z)-4-methylideneocta-5,7-dien-3-ol
SMILESC=C/C=C\C(=C)C(O)CC
InChIInChI=1S/C9H14O/c1-4-6-7-8(3)9(10)5-2/h4,6-7,9-10H,1,3,5H2,2H3/b7-6-
InChIKeyNFSAPNHSAZIHNL-SREVYHEPSA-N
MW138.21 g/mol
LogP2.06
Rot. Bonds4

About (5Z)-4-methylideneocta-5,7-dien-3-ol

(5Z)-4-methylideneocta-5,7-dien-3-ol (PubChem CID 143759474) has the molecular formula C9H14O and a molecular weight of 138.21 g/mol. Its IUPAC name is (5Z)-4-methylideneocta-5,7-dien-3-ol.

Molecular Properties

Compound Name(5Z)-4-methylideneocta-5,7-dien-3-ol
PubChem CID143759474
Molecular FormulaC9H14O
Molecular Weight138.21 g/mol
Exact Mass138.10
IUPAC Name(5Z)-4-methylideneocta-5,7-dien-3-ol
SMILESC=C/C=C\C(=C)C(O)CC
InChIInChI=1S/C9H14O/c1-4-6-7-8(3)9(10)5-2/h4,6-7,9-10H,1,3,5H2,2H3/b7-6-
InChIKeyNFSAPNHSAZIHNL-SREVYHEPSA-N
XLogP2.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;(3Z)-6-methyl-5-methylideneocta-1,3-diene;hydroiodide
CID 143199544
6-bromo-5-methylidenehepta-1,3-diene
CID 123730228
diethyl 2-[(3Z)-hexa-1,3,5-trien-2-yl]propanedioate
CID 143898880
ethane;(3Z)-8,8,9-trimethyl-5-methylidene-6-propan-2-ylundeca-1,3-diene
CID 178166429
2-methyl-3-methylidenehepta-4,6-dienoic acid
CID 123881666
(3Z,5Z)-4-ethylocta-1,3,5,7-tetraene
CID 142047079
5,6,7-trimethylnona-1,3,5-triene
CID 123607192
N-ethyl-3-methylidenehepta-4,6-dien-2-imine
CID 123979704
pent-1-ene-2,3-diol
CID 87754031
(5E)-octa-5,7-dien-3-ol
CID 12576352
7-methyl-5-methylideneocta-1,3-diene
CID 123347446
(5E)-4-methylocta-5,7-dien-3-ol
CID 15579187

Frequently Asked Questions

What is the IUPAC name of (5Z)-4-methylideneocta-5,7-dien-3-ol?
The IUPAC name of (5Z)-4-methylideneocta-5,7-dien-3-ol (CID 143759474) is (5Z)-4-methylideneocta-5,7-dien-3-ol.
What is the SMILES notation for (5Z)-4-methylideneocta-5,7-dien-3-ol?
The canonical SMILES for (5Z)-4-methylideneocta-5,7-dien-3-ol is C=C/C=C\C(=C)C(O)CC.
What is the InChIKey of (5Z)-4-methylideneocta-5,7-dien-3-ol?
The InChIKey is NFSAPNHSAZIHNL-SREVYHEPSA-N. The full InChI is InChI=1S/C9H14O/c1-4-6-7-8(3)9(10)5-2/h4,6-7,9-10H,1,3,5H2,2H3/b7-6-.
What are the key properties of (5Z)-4-methylideneocta-5,7-dien-3-ol?
(5Z)-4-methylideneocta-5,7-dien-3-ol has a molecular weight of 138.21 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-4-methylideneocta-5,7-dien-3-ol is sourced from PubChem (CID 143759474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).