(1S)-1,2,2,3,3,4-hexamethylinden-1-ol

C15H22O — CID 141477428

IUPAC(1S)-1,2,2,3,3,4-hexamethylinden-1-ol
SMILESCc1cccc2c1C(C)(C)C(C)(C)[C@]2(C)O
InChIInChI=1S/C15H22O/c1-10-8-7-9-11-12(10)13(2,3)14(4,5)15(11,6)16/h7-9,16H,1-6H3/t15-/m1/s1
InChIKeyFNFBFCNKBWWBGR-OAHLLOKOSA-N
MW218.34 g/mol
LogP3.52
Rot. Bonds

About (1S)-1,2,2,3,3,4-hexamethylinden-1-ol

(1S)-1,2,2,3,3,4-hexamethylinden-1-ol (PubChem CID 141477428) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is (1S)-1,2,2,3,3,4-hexamethylinden-1-ol.

Molecular Properties

Compound Name(1S)-1,2,2,3,3,4-hexamethylinden-1-ol
PubChem CID141477428
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name(1S)-1,2,2,3,3,4-hexamethylinden-1-ol
SMILESCc1cccc2c1C(C)(C)C(C)(C)[C@]2(C)O
InChIInChI=1S/C15H22O/c1-10-8-7-9-11-12(10)13(2,3)14(4,5)15(11,6)16/h7-9,16H,1-6H3/t15-/m1/s1
InChIKeyFNFBFCNKBWWBGR-OAHLLOKOSA-N
XLogP3.52
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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1,1,1',1',4,4'-hexamethyl-3,3'-spirobi[2H-indene]
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CID 14120481
1-(2-fluoro-3-methylphenyl)cyclopropan-1-ol
CID 81477688
1,1-difluoro-3,3,4-trimethyl-2H-indene
CID 170185955
3,7-dimethyl-3-phenyl-2H-1-benzofuran
CID 150065671
methane;9-methylfluoren-9-ol
CID 160708378
3,3-dimethyl-1-(2-methylphenyl)-2-benzofuran-1-ol
CID 15562711
2-(1-hydroxycyclopentyl)-3-methylphenol
CID 117104122
2-(1-hydroxycyclohexyl)-6-methylphenol
CID 117104328
1,9-dimethylfluorene-9-carbaldehyde
CID 173198715
ethane;2,3,3,7-tetramethyl-2H-1-benzofuran
CID 91295864

Frequently Asked Questions

What is the IUPAC name of (1S)-1,2,2,3,3,4-hexamethylinden-1-ol?
The IUPAC name of (1S)-1,2,2,3,3,4-hexamethylinden-1-ol (CID 141477428) is (1S)-1,2,2,3,3,4-hexamethylinden-1-ol.
What is the SMILES notation for (1S)-1,2,2,3,3,4-hexamethylinden-1-ol?
The canonical SMILES for (1S)-1,2,2,3,3,4-hexamethylinden-1-ol is Cc1cccc2c1C(C)(C)C(C)(C)[C@]2(C)O.
What is the InChIKey of (1S)-1,2,2,3,3,4-hexamethylinden-1-ol?
The InChIKey is FNFBFCNKBWWBGR-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H22O/c1-10-8-7-9-11-12(10)13(2,3)14(4,5)15(11,6)16/h7-9,16H,1-6H3/t15-/m1/s1.
What are the key properties of (1S)-1,2,2,3,3,4-hexamethylinden-1-ol?
(1S)-1,2,2,3,3,4-hexamethylinden-1-ol has a molecular weight of 218.34 g/mol, XLogP of 3.52, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1,2,2,3,3,4-hexamethylinden-1-ol is sourced from PubChem (CID 141477428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).