CID 59269205

C9H16O2 — CID 59269205

IUPAC—
SMILES[CH]CCC1COC(C)(C)OC1
InChIInChI=1S/C9H16O2/c1-4-5-8-6-10-9(2,3)11-7-8/h1,8H,4-7H2,2-3H3
InChIKeyDNPJONUAYFXVCU-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.88
Rot. Bonds2

About CID 59269205

CID 59269205 (PubChem CID 59269205) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol.

Molecular Properties

Compound NameCID 59269205
PubChem CID59269205
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name—
SMILES[CH]CCC1COC(C)(C)OC1
InChIInChI=1S/C9H16O2/c1-4-5-8-6-10-9(2,3)11-7-8/h1,8H,4-7H2,2-3H3
InChIKeyDNPJONUAYFXVCU-UHFFFAOYSA-N
XLogP1.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59269205?
The IUPAC name of CID 59269205 (CID 59269205) is not available.
What is the SMILES notation for CID 59269205?
The canonical SMILES for CID 59269205 is [CH]CCC1COC(C)(C)OC1.
What is the InChIKey of CID 59269205?
The InChIKey is DNPJONUAYFXVCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-4-5-8-6-10-9(2,3)11-7-8/h1,8H,4-7H2,2-3H3.
What are the key properties of CID 59269205?
CID 59269205 has a molecular weight of 156.22 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59269205 is sourced from PubChem (CID 59269205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).