10,11-dimethyldodecan-1-ol

C14H30O — CID 174615495

IUPAC10,11-dimethyldodecan-1-ol
SMILESCC(C)C(C)CCCCCCCCCO
InChIInChI=1S/C14H30O/c1-13(2)14(3)11-9-7-5-4-6-8-10-12-15/h13-15H,4-12H2,1-3H3
InChIKeyMXVFZXJQDNDEGA-UHFFFAOYSA-N
MW214.39 g/mol
LogP4.39
Rot. Bonds10

About 10,11-dimethyldodecan-1-ol

10,11-dimethyldodecan-1-ol (PubChem CID 174615495) has the molecular formula C14H30O and a molecular weight of 214.39 g/mol. Its IUPAC name is 10,11-dimethyldodecan-1-ol.

Molecular Properties

Compound Name10,11-dimethyldodecan-1-ol
PubChem CID174615495
Molecular FormulaC14H30O
Molecular Weight214.39 g/mol
Exact Mass214.23
IUPAC Name10,11-dimethyldodecan-1-ol
SMILESCC(C)C(C)CCCCCCCCCO
InChIInChI=1S/C14H30O/c1-13(2)14(3)11-9-7-5-4-6-8-10-12-15/h13-15H,4-12H2,1-3H3
InChIKeyMXVFZXJQDNDEGA-UHFFFAOYSA-N
XLogP4.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.39
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

7,8-dimethylnonan-1-ol
CID 87272618
9-methyldecane-1,8-diol
CID 107094660
7-methyloctane-1,6-diol
CID 54253773
(3S,7R)-2,3,7,8-tetramethylnonane
CID 153439349
(10S)-undecane-1,10-diol
CID 129382222
CID 172760633
CID 172760633
16-methylheptadecan-1-ol;titanium
CID 151630620
8,12-dimethylicosane-1,20-diol
CID 170848864
henicosane-1,20-diol
CID 86247204
hexadecane-1,15-diol
CID 53400630
alumane;6-methylheptan-1-ol
CID 174615736
2,3-dimethylnonacosane
CID 71331945

Frequently Asked Questions

What is the IUPAC name of 10,11-dimethyldodecan-1-ol?
The IUPAC name of 10,11-dimethyldodecan-1-ol (CID 174615495) is 10,11-dimethyldodecan-1-ol.
What is the SMILES notation for 10,11-dimethyldodecan-1-ol?
The canonical SMILES for 10,11-dimethyldodecan-1-ol is CC(C)C(C)CCCCCCCCCO.
What is the InChIKey of 10,11-dimethyldodecan-1-ol?
The InChIKey is MXVFZXJQDNDEGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O/c1-13(2)14(3)11-9-7-5-4-6-8-10-12-15/h13-15H,4-12H2,1-3H3.
What are the key properties of 10,11-dimethyldodecan-1-ol?
10,11-dimethyldodecan-1-ol has a molecular weight of 214.39 g/mol, XLogP of 4.39, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10,11-dimethyldodecan-1-ol is sourced from PubChem (CID 174615495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).