(2S,8R)-8-methyldecane-1,2-diol

C11H24O2 — CID 11469535

IUPAC(2S,8R)-8-methyldecane-1,2-diol
SMILESCC[C@@H](C)CCCCC[C@H](O)CO
InChIInChI=1S/C11H24O2/c1-3-10(2)7-5-4-6-8-11(13)9-12/h10-13H,3-9H2,1-2H3/t10-,11+/m1/s1
InChIKeyQNFMSAMYRKWKDZ-MNOVXSKESA-N
MW188.31 g/mol
LogP2.34
Rot. Bonds8

About (2S,8R)-8-methyldecane-1,2-diol

(2S,8R)-8-methyldecane-1,2-diol (PubChem CID 11469535) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is (2S,8R)-8-methyldecane-1,2-diol.

Molecular Properties

Compound Name(2S,8R)-8-methyldecane-1,2-diol
PubChem CID11469535
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name(2S,8R)-8-methyldecane-1,2-diol
SMILESCC[C@@H](C)CCCCC[C@H](O)CO
InChIInChI=1S/C11H24O2/c1-3-10(2)7-5-4-6-8-11(13)9-12/h10-13H,3-9H2,1-2H3/t10-,11+/m1/s1
InChIKeyQNFMSAMYRKWKDZ-MNOVXSKESA-N
XLogP2.34
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

7-methylnonane-1,2-diol
CID 144577410
decane-1,2,8-triol
CID 88722169
2,13-dimethylpentadecan-4-ol
CID 176880167
dodecane-1,2,11,12-tetrol
CID 71392430
(2R)-nonadecane-1,2-diol
CID 124511707
(7S)-7-methylnonan-1-ol
CID 11105641
(2R)-octane-1,2-diol
CID 6994435
(2R)-decane-1,2-diol
CID 10888425
triacontane-1,2-diol
CID 19770548
(2S)-24-methylpentacosane-1,2-diol
CID 162845743
(10S)-10-methyldodecan-1-ol
CID 11715372
14-methylhexadecan-1-ol
CID 5283264

Frequently Asked Questions

What is the IUPAC name of (2S,8R)-8-methyldecane-1,2-diol?
The IUPAC name of (2S,8R)-8-methyldecane-1,2-diol (CID 11469535) is (2S,8R)-8-methyldecane-1,2-diol.
What is the SMILES notation for (2S,8R)-8-methyldecane-1,2-diol?
The canonical SMILES for (2S,8R)-8-methyldecane-1,2-diol is CC[C@@H](C)CCCCC[C@H](O)CO.
What is the InChIKey of (2S,8R)-8-methyldecane-1,2-diol?
The InChIKey is QNFMSAMYRKWKDZ-MNOVXSKESA-N. The full InChI is InChI=1S/C11H24O2/c1-3-10(2)7-5-4-6-8-11(13)9-12/h10-13H,3-9H2,1-2H3/t10-,11+/m1/s1.
What are the key properties of (2S,8R)-8-methyldecane-1,2-diol?
(2S,8R)-8-methyldecane-1,2-diol has a molecular weight of 188.31 g/mol, XLogP of 2.34, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,8R)-8-methyldecane-1,2-diol is sourced from PubChem (CID 11469535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).