5-methoxy-6-methyldec-3-en-1-ol

C12H24O2 — CID 91234450

IUPAC5-methoxy-6-methyldec-3-en-1-ol
SMILESCCCCC(C)C(C=CCCO)OC
InChIInChI=1S/C12H24O2/c1-4-5-8-11(2)12(14-3)9-6-7-10-13/h6,9,11-13H,4-5,7-8,10H2,1-3H3
InChIKeyKCTJNYYVXJZBLQ-UHFFFAOYSA-N
MW200.32 g/mol
LogP2.77
Rot. Bonds8

About 5-methoxy-6-methyldec-3-en-1-ol

5-methoxy-6-methyldec-3-en-1-ol (PubChem CID 91234450) has the molecular formula C12H24O2 and a molecular weight of 200.32 g/mol. Its IUPAC name is 5-methoxy-6-methyldec-3-en-1-ol.

Molecular Properties

Compound Name5-methoxy-6-methyldec-3-en-1-ol
PubChem CID91234450
Molecular FormulaC12H24O2
Molecular Weight200.32 g/mol
Exact Mass200.18
IUPAC Name5-methoxy-6-methyldec-3-en-1-ol
SMILESCCCCC(C)C(C=CCCO)OC
InChIInChI=1S/C12H24O2/c1-4-5-8-11(2)12(14-3)9-6-7-10-13/h6,9,11-13H,4-5,7-8,10H2,1-3H3
InChIKeyKCTJNYYVXJZBLQ-UHFFFAOYSA-N
XLogP2.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-5-methoxy-6-methyldec-3-en-2-one
CID 87291566
5-methoxy-6-methyldec-3-en-2-one
CID 91554031
(E)-5,6-dimethylhexadec-7-ene
CID 173368393
(E)-8-propyldodec-3-en-1-ol
CID 22480549
(E)-3-methylundec-4-en-1-ol
CID 121006781
(E,2S,3R)-2-(ethylamino)-3-methoxyoctadec-4-en-1-ol
CID 121392060
9-hexan-2-ylpentadec-7-ene
CID 57270482
(16R)-icosa-5,14-diene-1,16-diol
CID 91200816
heptadec-3-en-1-ol
CID 86130004
(E)-hept-2-ene-1,1-diol
CID 87660901
(E)-heptadec-3-en-1-ol
CID 170849265
(3E,5E)-deca-3,5-dien-1-ol
CID 118460601

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-6-methyldec-3-en-1-ol?
The IUPAC name of 5-methoxy-6-methyldec-3-en-1-ol (CID 91234450) is 5-methoxy-6-methyldec-3-en-1-ol.
What is the SMILES notation for 5-methoxy-6-methyldec-3-en-1-ol?
The canonical SMILES for 5-methoxy-6-methyldec-3-en-1-ol is CCCCC(C)C(C=CCCO)OC.
What is the InChIKey of 5-methoxy-6-methyldec-3-en-1-ol?
The InChIKey is KCTJNYYVXJZBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2/c1-4-5-8-11(2)12(14-3)9-6-7-10-13/h6,9,11-13H,4-5,7-8,10H2,1-3H3.
What are the key properties of 5-methoxy-6-methyldec-3-en-1-ol?
5-methoxy-6-methyldec-3-en-1-ol has a molecular weight of 200.32 g/mol, XLogP of 2.77, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-6-methyldec-3-en-1-ol is sourced from PubChem (CID 91234450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).