(4R,8S)-4,8-dimethyldecan-1-ol

C12H26O — CID 121007505

IUPAC(4R,8S)-4,8-dimethyldecan-1-ol
SMILESCC[C@H](C)CCC[C@@H](C)CCCO
InChIInChI=1S/C12H26O/c1-4-11(2)7-5-8-12(3)9-6-10-13/h11-13H,4-10H2,1-3H3/t11-,12+/m0/s1
InChIKeyQZKFSNSXOYRLSX-NWDGAFQWSA-N
MW186.34 g/mol
LogP3.61
Rot. Bonds8

About (4R,8S)-4,8-dimethyldecan-1-ol

(4R,8S)-4,8-dimethyldecan-1-ol (PubChem CID 121007505) has the molecular formula C12H26O and a molecular weight of 186.34 g/mol. Its IUPAC name is (4R,8S)-4,8-dimethyldecan-1-ol.

Molecular Properties

Compound Name(4R,8S)-4,8-dimethyldecan-1-ol
PubChem CID121007505
Molecular FormulaC12H26O
Molecular Weight186.34 g/mol
Exact Mass186.20
IUPAC Name(4R,8S)-4,8-dimethyldecan-1-ol
SMILESCC[C@H](C)CCC[C@@H](C)CCCO
InChIInChI=1S/C12H26O/c1-4-11(2)7-5-8-12(3)9-6-10-13/h11-13H,4-10H2,1-3H3/t11-,12+/m0/s1
InChIKeyQZKFSNSXOYRLSX-NWDGAFQWSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (4R,8S)-4,8-dimethyldecan-1-ol?
The IUPAC name of (4R,8S)-4,8-dimethyldecan-1-ol (CID 121007505) is (4R,8S)-4,8-dimethyldecan-1-ol.
What is the SMILES notation for (4R,8S)-4,8-dimethyldecan-1-ol?
The canonical SMILES for (4R,8S)-4,8-dimethyldecan-1-ol is CC[C@H](C)CCC[C@@H](C)CCCO.
What is the InChIKey of (4R,8S)-4,8-dimethyldecan-1-ol?
The InChIKey is QZKFSNSXOYRLSX-NWDGAFQWSA-N. The full InChI is InChI=1S/C12H26O/c1-4-11(2)7-5-8-12(3)9-6-10-13/h11-13H,4-10H2,1-3H3/t11-,12+/m0/s1.
What are the key properties of (4R,8S)-4,8-dimethyldecan-1-ol?
(4R,8S)-4,8-dimethyldecan-1-ol has a molecular weight of 186.34 g/mol, XLogP of 3.61, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,8S)-4,8-dimethyldecan-1-ol is sourced from PubChem (CID 121007505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).