3-methyl-5-methylidenedecan-1-ol

C12H24O — CID 164909455

IUPAC3-methyl-5-methylidenedecan-1-ol
SMILESC=C(CCCCC)CC(C)CCO
InChIInChI=1S/C12H24O/c1-4-5-6-7-11(2)10-12(3)8-9-13/h12-13H,2,4-10H2,1,3H3
InChIKeyJIIFGRYFJXWOBX-UHFFFAOYSA-N
MW184.32 g/mol
LogP3.53
Rot. Bonds8

About 3-methyl-5-methylidenedecan-1-ol

3-methyl-5-methylidenedecan-1-ol (PubChem CID 164909455) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is 3-methyl-5-methylidenedecan-1-ol.

Molecular Properties

Compound Name3-methyl-5-methylidenedecan-1-ol
PubChem CID164909455
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name3-methyl-5-methylidenedecan-1-ol
SMILESC=C(CCCCC)CC(C)CCO
InChIInChI=1S/C12H24O/c1-4-5-6-7-11(2)10-12(3)8-9-13/h12-13H,2,4-10H2,1,3H3
InChIKeyJIIFGRYFJXWOBX-UHFFFAOYSA-N
XLogP3.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 53.53
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

5-methyl-9-methylidenetetradecane
CID 142037910
(3S)-3-methyl-6-methylidenehenicosane
CID 174024311
bis(hexanoic acid);3-methylpentane-1,5-diol
CID 87072933
(3S)-3-methylnonacosan-1-ol
CID 10836783
2-methyl-5-methylideneundecane
CID 54320712
2-methyl-4-methylidenenonanenitrile
CID 139366758
6-methylidenedodecane
CID 21453027
6-methylidenetetradecane
CID 21477883
(3S,7S,11S,15S)-3,7,11,15-tetramethyldocosan-1-ol
CID 71733863
18,23-dimethylidene-20-propyltetracontane
CID 164602954
3,5-dimethyl-10-methylidenepentadecane
CID 123460821
2-methylidenepentadecan-1-ol
CID 10847661

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-methylidenedecan-1-ol?
The IUPAC name of 3-methyl-5-methylidenedecan-1-ol (CID 164909455) is 3-methyl-5-methylidenedecan-1-ol.
What is the SMILES notation for 3-methyl-5-methylidenedecan-1-ol?
The canonical SMILES for 3-methyl-5-methylidenedecan-1-ol is C=C(CCCCC)CC(C)CCO.
What is the InChIKey of 3-methyl-5-methylidenedecan-1-ol?
The InChIKey is JIIFGRYFJXWOBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O/c1-4-5-6-7-11(2)10-12(3)8-9-13/h12-13H,2,4-10H2,1,3H3.
What are the key properties of 3-methyl-5-methylidenedecan-1-ol?
3-methyl-5-methylidenedecan-1-ol has a molecular weight of 184.32 g/mol, XLogP of 3.53, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-methylidenedecan-1-ol is sourced from PubChem (CID 164909455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).