4,4-bis(methoxymethyl)-3,7-dimethylnonane

C15H32O2 — CID 177251110

IUPAC4,4-bis(methoxymethyl)-3,7-dimethylnonane
SMILESCCC(C)CCC(COC)(COC)C(C)CC
InChIInChI=1S/C15H32O2/c1-7-13(3)9-10-15(11-16-5,12-17-6)14(4)8-2/h13-14H,7-12H2,1-6H3
InChIKeyCKDGEFLSWAEKQS-UHFFFAOYSA-N
MW244.42 g/mol
LogP4.14
Rot. Bonds10

About 4,4-bis(methoxymethyl)-3,7-dimethylnonane

4,4-bis(methoxymethyl)-3,7-dimethylnonane (PubChem CID 177251110) has the molecular formula C15H32O2 and a molecular weight of 244.42 g/mol. Its IUPAC name is 4,4-bis(methoxymethyl)-3,7-dimethylnonane.

Molecular Properties

Compound Name4,4-bis(methoxymethyl)-3,7-dimethylnonane
PubChem CID177251110
Molecular FormulaC15H32O2
Molecular Weight244.42 g/mol
Exact Mass244.24
IUPAC Name4,4-bis(methoxymethyl)-3,7-dimethylnonane
SMILESCCC(C)CCC(COC)(COC)C(C)CC
InChIInChI=1S/C15H32O2/c1-7-13(3)9-10-15(11-16-5,12-17-6)14(4)8-2/h13-14H,7-12H2,1-6H3
InChIKeyCKDGEFLSWAEKQS-UHFFFAOYSA-N
XLogP4.14
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.42
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-bis(methoxymethyl)-2-methylpentane
CID 89106557
3,3-bis(methoxymethyl)-2,6-dimethylheptane;3,3-bis(methoxymethyl)-2,4-dimethylpentane
CID 22373213
2,2-difluoro-1-methoxy-4-methylhexane
CID 162613341
3,6,9-trimethylundecan-6-amine
CID 90972549
3-(methoxymethyl)-6-methyl-3-propan-2-ylheptan-1-ol
CID 170393196
5,5-bis(methoxymethyl)-3-methylnonane
CID 141250163
4-butan-2-yl-3,4,7,9-tetramethylundecane
CID 123680374
1-methoxy-2,22-dimethyltetracosane
CID 86173032
3,5,5,8-tetramethyldecane
CID 57491683
1-methoxy-3-methyl-3-(3-methylpentoxy)pentane
CID 89083438
2,5-dimethylheptan-2-yl carbamate
CID 123535810
3-methoxy-3,7-dimethylnonane
CID 118351298

Frequently Asked Questions

What is the IUPAC name of 4,4-bis(methoxymethyl)-3,7-dimethylnonane?
The IUPAC name of 4,4-bis(methoxymethyl)-3,7-dimethylnonane (CID 177251110) is 4,4-bis(methoxymethyl)-3,7-dimethylnonane.
What is the SMILES notation for 4,4-bis(methoxymethyl)-3,7-dimethylnonane?
The canonical SMILES for 4,4-bis(methoxymethyl)-3,7-dimethylnonane is CCC(C)CCC(COC)(COC)C(C)CC.
What is the InChIKey of 4,4-bis(methoxymethyl)-3,7-dimethylnonane?
The InChIKey is CKDGEFLSWAEKQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2/c1-7-13(3)9-10-15(11-16-5,12-17-6)14(4)8-2/h13-14H,7-12H2,1-6H3.
What are the key properties of 4,4-bis(methoxymethyl)-3,7-dimethylnonane?
4,4-bis(methoxymethyl)-3,7-dimethylnonane has a molecular weight of 244.42 g/mol, XLogP of 4.14, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-bis(methoxymethyl)-3,7-dimethylnonane is sourced from PubChem (CID 177251110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).