10-methyl-9-propylicos-9-ene

C24H48 — CID 57290137

IUPAC10-methyl-9-propylicos-9-ene
SMILESCCCCCCCCCCC(C)=C(CCC)CCCCCCCC
InChIInChI=1S/C24H48/c1-5-8-10-12-14-15-16-18-21-23(4)24(20-7-3)22-19-17-13-11-9-6-2/h5-22H2,1-4H3
InChIKeyAVVWJAZXJGEGJG-UHFFFAOYSA-N
MW336.65 g/mol
LogP9.38
Rot. Bonds18

About 10-methyl-9-propylicos-9-ene

10-methyl-9-propylicos-9-ene (PubChem CID 57290137) has the molecular formula C24H48 and a molecular weight of 336.65 g/mol. Its IUPAC name is 10-methyl-9-propylicos-9-ene.

Molecular Properties

Compound Name10-methyl-9-propylicos-9-ene
PubChem CID57290137
Molecular FormulaC24H48
Molecular Weight336.65 g/mol
Exact Mass336.38
IUPAC Name10-methyl-9-propylicos-9-ene
SMILESCCCCCCCCCCC(C)=C(CCC)CCCCCCCC
InChIInChI=1S/C24H48/c1-5-8-10-12-14-15-16-18-21-23(4)24(20-7-3)22-19-17-13-11-9-6-2/h5-22H2,1-4H3
InChIKeyAVVWJAZXJGEGJG-UHFFFAOYSA-N
XLogP9.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.65
LogP ≤ 59.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

(Z)-10-methyl-9-propylicos-9-ene
CID 18601799
8,9-dimethylhexadec-8-ene
CID 140717938
9,10-dioctyloctadec-9-ene
CID 10814462
(E)-3-methyl-4-propyloct-3-ene
CID 57107532
(E)-3-propyloct-2-en-2-ol
CID 142123066
2,3-dimethyltridec-2-ene
CID 22376033
5,6-dibutyltetradec-5-ene
CID 19866346
(E)-3,4-dimethylicos-3-ene
CID 173263978
3-methyloctadec-2-en-2-amine
CID 87741791
5-ethyl-4-methylnon-4-ene
CID 143021471
[(2Z)-2-decan-2-ylidenedodecyl]benzene
CID 91256023
6-butyl-7-ethyltetradec-6-ene
CID 57142303

Frequently Asked Questions

What is the IUPAC name of 10-methyl-9-propylicos-9-ene?
The IUPAC name of 10-methyl-9-propylicos-9-ene (CID 57290137) is 10-methyl-9-propylicos-9-ene.
What is the SMILES notation for 10-methyl-9-propylicos-9-ene?
The canonical SMILES for 10-methyl-9-propylicos-9-ene is CCCCCCCCCCC(C)=C(CCC)CCCCCCCC.
What is the InChIKey of 10-methyl-9-propylicos-9-ene?
The InChIKey is AVVWJAZXJGEGJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H48/c1-5-8-10-12-14-15-16-18-21-23(4)24(20-7-3)22-19-17-13-11-9-6-2/h5-22H2,1-4H3.
What are the key properties of 10-methyl-9-propylicos-9-ene?
10-methyl-9-propylicos-9-ene has a molecular weight of 336.65 g/mol, XLogP of 9.38, 18 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-9-propylicos-9-ene is sourced from PubChem (CID 57290137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).