7-ethyl-5-methoxy-4-(methoxymethyl)undecane

C16H34O2 — CID 150587909

IUPAC7-ethyl-5-methoxy-4-(methoxymethyl)undecane
SMILESCCCCC(CC)CC(OC)C(CCC)COC
InChIInChI=1S/C16H34O2/c1-6-9-11-14(8-3)12-16(18-5)15(10-7-2)13-17-4/h14-16H,6-13H2,1-5H3
InChIKeyIPFYVNCWMVFAOA-UHFFFAOYSA-N
MW258.45 g/mol
LogP4.67
Rot. Bonds12

About 7-ethyl-5-methoxy-4-(methoxymethyl)undecane

7-ethyl-5-methoxy-4-(methoxymethyl)undecane (PubChem CID 150587909) has the molecular formula C16H34O2 and a molecular weight of 258.45 g/mol. Its IUPAC name is 7-ethyl-5-methoxy-4-(methoxymethyl)undecane.

Molecular Properties

Compound Name7-ethyl-5-methoxy-4-(methoxymethyl)undecane
PubChem CID150587909
Molecular FormulaC16H34O2
Molecular Weight258.45 g/mol
Exact Mass258.26
IUPAC Name7-ethyl-5-methoxy-4-(methoxymethyl)undecane
SMILESCCCCC(CC)CC(OC)C(CCC)COC
InChIInChI=1S/C16H34O2/c1-6-9-11-14(8-3)12-16(18-5)15(10-7-2)13-17-4/h14-16H,6-13H2,1-5H3
InChIKeyIPFYVNCWMVFAOA-UHFFFAOYSA-N
XLogP4.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.45
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-ethyl-3-methoxy-4-(methoxymethyl)-2-methyldecane
CID 141430108
4,5,7-triethylundecane
CID 123222302
5,8-diethyl-6-(2-ethylhexoxy)dodecane
CID 123215209
5,9-diethyl-7-(2-ethylpentyl)tridecane
CID 170533070
5,6-bis(methoxymethyl)undecane
CID 142709817
5-(methoxymethyl)decane
CID 123387036
(5S)-3,5-diethylnonane;methane
CID 159387669
(3R)-8-(methoxymethyl)-3,7-dimethyl-6-propyldodecane
CID 172616679
6-ethyl-4-methyldecane
CID 22224210
5,8-diethyldodecan-6-yl dihydrogen phosphite
CID 21249648
bis(5,8-diethyldodecan-6-yloxy)-oxophosphanium
CID 23131996
8-(methoxymethyl)-2,6,7-trimethyl-5-propyldodecane
CID 172616922

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-5-methoxy-4-(methoxymethyl)undecane?
The IUPAC name of 7-ethyl-5-methoxy-4-(methoxymethyl)undecane (CID 150587909) is 7-ethyl-5-methoxy-4-(methoxymethyl)undecane.
What is the SMILES notation for 7-ethyl-5-methoxy-4-(methoxymethyl)undecane?
The canonical SMILES for 7-ethyl-5-methoxy-4-(methoxymethyl)undecane is CCCCC(CC)CC(OC)C(CCC)COC.
What is the InChIKey of 7-ethyl-5-methoxy-4-(methoxymethyl)undecane?
The InChIKey is IPFYVNCWMVFAOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2/c1-6-9-11-14(8-3)12-16(18-5)15(10-7-2)13-17-4/h14-16H,6-13H2,1-5H3.
What are the key properties of 7-ethyl-5-methoxy-4-(methoxymethyl)undecane?
7-ethyl-5-methoxy-4-(methoxymethyl)undecane has a molecular weight of 258.45 g/mol, XLogP of 4.67, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-5-methoxy-4-(methoxymethyl)undecane is sourced from PubChem (CID 150587909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).