1-oxaspiro[4.4]nonan-2-ylmethanol

C9H16O2 — CID 14667614

IUPAC1-oxaspiro[4.4]nonan-2-ylmethanol
SMILESOCC1CCC2(CCCC2)O1
InChIInChI=1S/C9H16O2/c10-7-8-3-6-9(11-8)4-1-2-5-9/h8,10H,1-7H2
InChIKeyBZLNWPNHFDYHJX-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.47
Rot. Bonds1

About 1-oxaspiro[4.4]nonan-2-ylmethanol

1-oxaspiro[4.4]nonan-2-ylmethanol (PubChem CID 14667614) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 1-oxaspiro[4.4]nonan-2-ylmethanol.

Molecular Properties

Compound Name1-oxaspiro[4.4]nonan-2-ylmethanol
PubChem CID14667614
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name1-oxaspiro[4.4]nonan-2-ylmethanol
SMILESOCC1CCC2(CCCC2)O1
InChIInChI=1S/C9H16O2/c10-7-8-3-6-9(11-8)4-1-2-5-9/h8,10H,1-7H2
InChIKeyBZLNWPNHFDYHJX-UHFFFAOYSA-N
XLogP1.47
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-oxaspiro[4.4]nonan-2-ylmethanol?
The IUPAC name of 1-oxaspiro[4.4]nonan-2-ylmethanol (CID 14667614) is 1-oxaspiro[4.4]nonan-2-ylmethanol.
What is the SMILES notation for 1-oxaspiro[4.4]nonan-2-ylmethanol?
The canonical SMILES for 1-oxaspiro[4.4]nonan-2-ylmethanol is OCC1CCC2(CCCC2)O1.
What is the InChIKey of 1-oxaspiro[4.4]nonan-2-ylmethanol?
The InChIKey is BZLNWPNHFDYHJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c10-7-8-3-6-9(11-8)4-1-2-5-9/h8,10H,1-7H2.
What are the key properties of 1-oxaspiro[4.4]nonan-2-ylmethanol?
1-oxaspiro[4.4]nonan-2-ylmethanol has a molecular weight of 156.22 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxaspiro[4.4]nonan-2-ylmethanol is sourced from PubChem (CID 14667614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).