(1-methoxy-2-methyl-1-phenyldecyl)benzene

C24H34O — CID 158531120

IUPAC(1-methoxy-2-methyl-1-phenyldecyl)benzene
SMILESCCCCCCCCC(C)C(OC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H34O/c1-4-5-6-7-8-11-16-21(2)24(25-3,22-17-12-9-13-18-22)23-19-14-10-15-20-23/h9-10,12-15,17-21H,4-8,11,16H2,1-3H3
InChIKeyHNJNQKPJAAZCIG-UHFFFAOYSA-N
MW338.54 g/mol
LogP6.96
Rot. Bonds11

About (1-methoxy-2-methyl-1-phenyldecyl)benzene

(1-methoxy-2-methyl-1-phenyldecyl)benzene (PubChem CID 158531120) has the molecular formula C24H34O and a molecular weight of 338.54 g/mol. Its IUPAC name is (1-methoxy-2-methyl-1-phenyldecyl)benzene.

Molecular Properties

Compound Name(1-methoxy-2-methyl-1-phenyldecyl)benzene
PubChem CID158531120
Molecular FormulaC24H34O
Molecular Weight338.54 g/mol
Exact Mass338.26
IUPAC Name(1-methoxy-2-methyl-1-phenyldecyl)benzene
SMILESCCCCCCCCC(C)C(OC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H34O/c1-4-5-6-7-8-11-16-21(2)24(25-3,22-17-12-9-13-18-22)23-19-14-10-15-20-23/h9-10,12-15,17-21H,4-8,11,16H2,1-3H3
InChIKeyHNJNQKPJAAZCIG-UHFFFAOYSA-N
XLogP6.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.54
LogP ≤ 56.96
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

(2-tert-butyl-1-methoxy-1-phenyldecyl)benzene
CID 151749731
(1,1-dimethoxy-2-octylundecyl)benzene
CID 151680252
(1,1-dimethoxy-2-octyldodecyl)benzene
CID 150569123
(3-methyl-2-phenyloctan-2-yl)benzene
CID 174435866
(2-butyl-1,1-diphenyldecyl)benzene
CID 150177254
3-methyl-2-phenoxynonadecan-2-amine;hydrochloride
CID 175368609
2,2-dimethoxyundecan-3-ylbenzene
CID 152553562
1-phenyl-2-propan-2-yldecane-1,1-diol
CID 151363908
2-methoxy-2,3-dimethylundecane
CID 150941081
3-(1-methoxy-1-phenylethyl)peroxynonanal
CID 122230406
(2-cyclohexyl-1,1-dimethoxydecyl)benzene
CID 150097969
benzene;1,1,1-triethoxy-2-methyldecane
CID 159401472

Frequently Asked Questions

What is the IUPAC name of (1-methoxy-2-methyl-1-phenyldecyl)benzene?
The IUPAC name of (1-methoxy-2-methyl-1-phenyldecyl)benzene (CID 158531120) is (1-methoxy-2-methyl-1-phenyldecyl)benzene.
What is the SMILES notation for (1-methoxy-2-methyl-1-phenyldecyl)benzene?
The canonical SMILES for (1-methoxy-2-methyl-1-phenyldecyl)benzene is CCCCCCCCC(C)C(OC)(c1ccccc1)c1ccccc1.
What is the InChIKey of (1-methoxy-2-methyl-1-phenyldecyl)benzene?
The InChIKey is HNJNQKPJAAZCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34O/c1-4-5-6-7-8-11-16-21(2)24(25-3,22-17-12-9-13-18-22)23-19-14-10-15-20-23/h9-10,12-15,17-21H,4-8,11,16H2,1-3H3.
What are the key properties of (1-methoxy-2-methyl-1-phenyldecyl)benzene?
(1-methoxy-2-methyl-1-phenyldecyl)benzene has a molecular weight of 338.54 g/mol, XLogP of 6.96, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxy-2-methyl-1-phenyldecyl)benzene is sourced from PubChem (CID 158531120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).