CID 59269267

C8H14O2 — CID 59269267

IUPAC—
SMILES[CH]CC1COC(C)(C)OC1
InChIInChI=1S/C8H14O2/c1-4-7-5-9-8(2,3)10-6-7/h1,7H,4-6H2,2-3H3
InChIKeyJTTJQKCNALORRL-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.49
Rot. Bonds1

About CID 59269267

CID 59269267 (PubChem CID 59269267) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol.

Molecular Properties

Compound NameCID 59269267
PubChem CID59269267
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name—
SMILES[CH]CC1COC(C)(C)OC1
InChIInChI=1S/C8H14O2/c1-4-7-5-9-8(2,3)10-6-7/h1,7H,4-6H2,2-3H3
InChIKeyJTTJQKCNALORRL-UHFFFAOYSA-N
XLogP1.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59269267?
The IUPAC name of CID 59269267 (CID 59269267) is not available.
What is the SMILES notation for CID 59269267?
The canonical SMILES for CID 59269267 is [CH]CC1COC(C)(C)OC1.
What is the InChIKey of CID 59269267?
The InChIKey is JTTJQKCNALORRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-4-7-5-9-8(2,3)10-6-7/h1,7H,4-6H2,2-3H3.
What are the key properties of CID 59269267?
CID 59269267 has a molecular weight of 142.20 g/mol, XLogP of 1.49, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59269267 is sourced from PubChem (CID 59269267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).