(3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol

C10H18O — CID 130634198

IUPAC(3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol
SMILESCC1(C)C[C@]2(CC2(C)C)C1O
InChIInChI=1S/C10H18O/c1-8(2)5-10(7(8)11)6-9(10,3)4/h7,11H,5-6H2,1-4H3/t7?,10-/m0/s1
InChIKeyLWFPOLZSXOTDRG-MHPPCMCBSA-N
MW154.25 g/mol
LogP2.19
Rot. Bonds

About (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol

(3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol (PubChem CID 130634198) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol.

Molecular Properties

Compound Name(3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol
PubChem CID130634198
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol
SMILESCC1(C)C[C@]2(CC2(C)C)C1O
InChIInChI=1S/C10H18O/c1-8(2)5-10(7(8)11)6-9(10,3)4/h7,11H,5-6H2,1-4H3/t7?,10-/m0/s1
InChIKeyLWFPOLZSXOTDRG-MHPPCMCBSA-N
XLogP2.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol?
The IUPAC name of (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol (CID 130634198) is (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol.
What is the SMILES notation for (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol?
The canonical SMILES for (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol is CC1(C)C[C@]2(CC2(C)C)C1O.
What is the InChIKey of (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol?
The InChIKey is LWFPOLZSXOTDRG-MHPPCMCBSA-N. The full InChI is InChI=1S/C10H18O/c1-8(2)5-10(7(8)11)6-9(10,3)4/h7,11H,5-6H2,1-4H3/t7?,10-/m0/s1.
What are the key properties of (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol?
(3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol has a molecular weight of 154.25 g/mol, XLogP of 2.19, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-2,2,5,5-tetramethylspiro[2.3]hexan-6-ol is sourced from PubChem (CID 130634198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).