10-methoxy-10-propylicosane

C24H50O — CID 158279749

IUPAC10-methoxy-10-propylicosane
SMILESCCCCCCCCCCC(CCC)(CCCCCCCCC)OC
InChIInChI=1S/C24H50O/c1-5-8-10-12-14-16-18-20-23-24(25-4,21-7-3)22-19-17-15-13-11-9-6-2/h5-23H2,1-4H3
InChIKeyGKBLKGNHHNRTCG-UHFFFAOYSA-N
MW354.66 g/mol
LogP8.84
Rot. Bonds20

About 10-methoxy-10-propylicosane

10-methoxy-10-propylicosane (PubChem CID 158279749) has the molecular formula C24H50O and a molecular weight of 354.66 g/mol. Its IUPAC name is 10-methoxy-10-propylicosane.

Molecular Properties

Compound Name10-methoxy-10-propylicosane
PubChem CID158279749
Molecular FormulaC24H50O
Molecular Weight354.66 g/mol
Exact Mass354.39
IUPAC Name10-methoxy-10-propylicosane
SMILESCCCCCCCCCCC(CCC)(CCCCCCCCC)OC
InChIInChI=1S/C24H50O/c1-5-8-10-12-14-16-18-20-23-24(25-4,21-7-3)22-19-17-15-13-11-9-6-2/h5-23H2,1-4H3
InChIKeyGKBLKGNHHNRTCG-UHFFFAOYSA-N
XLogP8.84
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.66
LogP ≤ 58.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

10-methoxy-10-propyltricosane
CID 159618690
11-methoxy-11-nonyltetracosane
CID 159441841
3-methoxy-3-propyloctan-1-ol
CID 142753036
3-ethyl-3-methoxydecane
CID 89190150
11-propyl-11-(11-propylhenicosan-11-ylperoxy)henicosane
CID 155668142
14-tridecyloctacosan-14-yloxysilane
CID 173060340
1,1,1-trimethoxytridecane
CID 102481821
17-hexadecyltetratriacontan-17-yloxysilane
CID 173060502
5-methoxy-5-(3-methoxypropyl)nonane
CID 141413448
5-propylnonan-5-yloxyphosphane
CID 23352969
4-hydroperoxyperoxy-4-propylpentadecane
CID 140640166
4-propoxyperoxy-4-propylundecane
CID 90111680

Frequently Asked Questions

What is the IUPAC name of 10-methoxy-10-propylicosane?
The IUPAC name of 10-methoxy-10-propylicosane (CID 158279749) is 10-methoxy-10-propylicosane.
What is the SMILES notation for 10-methoxy-10-propylicosane?
The canonical SMILES for 10-methoxy-10-propylicosane is CCCCCCCCCCC(CCC)(CCCCCCCCC)OC.
What is the InChIKey of 10-methoxy-10-propylicosane?
The InChIKey is GKBLKGNHHNRTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H50O/c1-5-8-10-12-14-16-18-20-23-24(25-4,21-7-3)22-19-17-15-13-11-9-6-2/h5-23H2,1-4H3.
What are the key properties of 10-methoxy-10-propylicosane?
10-methoxy-10-propylicosane has a molecular weight of 354.66 g/mol, XLogP of 8.84, 20 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methoxy-10-propylicosane is sourced from PubChem (CID 158279749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).