2-methylideneoct-7-en-1-ol

C9H16O — CID 12917066

IUPAC2-methylideneoct-7-en-1-ol
SMILESC=CCCCCC(=C)CO
InChIInChI=1S/C9H16O/c1-3-4-5-6-7-9(2)8-10/h3,10H,1-2,4-8H2
InChIKeyIFMWODUAEIMUED-UHFFFAOYSA-N
MW140.23 g/mol
LogP2.28
Rot. Bonds6

About 2-methylideneoct-7-en-1-ol

2-methylideneoct-7-en-1-ol (PubChem CID 12917066) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is 2-methylideneoct-7-en-1-ol.

Molecular Properties

Compound Name2-methylideneoct-7-en-1-ol
PubChem CID12917066
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name2-methylideneoct-7-en-1-ol
SMILESC=CCCCCC(=C)CO
InChIInChI=1S/C9H16O/c1-3-4-5-6-7-9(2)8-10/h3,10H,1-2,4-8H2
InChIKeyIFMWODUAEIMUED-UHFFFAOYSA-N
XLogP2.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

9-methylideneicosa-1,19-diene
CID 173334659
7-methylidenedec-1-ene
CID 123417470
8-methylidenedodec-1-ene
CID 169088157
3,8-dimethylidenetetradecane;bis(oct-1-ene)
CID 173443691
heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
7-ethylnona-1,7-diene
CID 54551079
2-methoxyocta-1,7-diene
CID 16726270
tricosa-1,22-dien-12-one
CID 86210796
methyl undec-10-enedithioate
CID 134988678
hept-6-enoic acid;undec-10-enoic acid
CID 87675195
tritriacont-32-enoic acid
CID 54063641

Frequently Asked Questions

What is the IUPAC name of 2-methylideneoct-7-en-1-ol?
The IUPAC name of 2-methylideneoct-7-en-1-ol (CID 12917066) is 2-methylideneoct-7-en-1-ol.
What is the SMILES notation for 2-methylideneoct-7-en-1-ol?
The canonical SMILES for 2-methylideneoct-7-en-1-ol is C=CCCCCC(=C)CO.
What is the InChIKey of 2-methylideneoct-7-en-1-ol?
The InChIKey is IFMWODUAEIMUED-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O/c1-3-4-5-6-7-9(2)8-10/h3,10H,1-2,4-8H2.
What are the key properties of 2-methylideneoct-7-en-1-ol?
2-methylideneoct-7-en-1-ol has a molecular weight of 140.23 g/mol, XLogP of 2.28, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylideneoct-7-en-1-ol is sourced from PubChem (CID 12917066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).