CID 59376423

C8H14O2 — CID 59376423

IUPAC—
SMILES[CH]CC1CCOC(C)(C)O1
InChIInChI=1S/C8H14O2/c1-4-7-5-6-9-8(2,3)10-7/h1,7H,4-6H2,2-3H3
InChIKeyKYZANWPEPRKHGT-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.63
Rot. Bonds1

About CID 59376423

CID 59376423 (PubChem CID 59376423) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol.

Molecular Properties

Compound NameCID 59376423
PubChem CID59376423
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name—
SMILES[CH]CC1CCOC(C)(C)O1
InChIInChI=1S/C8H14O2/c1-4-7-5-6-9-8(2,3)10-7/h1,7H,4-6H2,2-3H3
InChIKeyKYZANWPEPRKHGT-UHFFFAOYSA-N
XLogP1.63
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 ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(chloromethyl)-2,2-dimethyl-1,3-dioxane
CID 130696615
(4S)-4-(chloromethyl)-2,2-dimethyl-1,3-dioxane
CID 174865524
2-(2,2-dimethyl-1,3-dioxan-4-yl)ethanol
CID 18471524
(4S,6S)-4-[[(4S)-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-6-[[(4S,6S)-6-[[(4S,6R)-6-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxane
CID 11585308
(4S)-2,2,4-trimethyl-1,3-dioxane
CID 12587732
CID 59269279
CID 59269279
cyclopentyl 2-(2,2-dimethyl-1,3-dioxan-4-yl)acetate
CID 174718969
(2S,3S)-1-[(4S)-2,2-dimethyl-1,3-dioxan-4-yl]-3-methylpent-4-en-2-ol
CID 101165465
(2R,3E,5E)-1-[(4R)-2,2-dimethyl-1,3-dioxan-4-yl]hepta-3,5-dien-2-ol
CID 102446786
4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-2,2-dimethyl-1,3-dioxolane
CID 58862633
(4S)-2,2-dimethyl-4-(2-methylbutan-2-yl)-1,3-dioxane
CID 141061915
(4R)-4-(cyclopropylmethyl)-2,2-dimethyl-1,3-dioxolane
CID 123766397

Frequently Asked Questions

What is the IUPAC name of CID 59376423?
The IUPAC name of CID 59376423 (CID 59376423) is not available.
What is the SMILES notation for CID 59376423?
The canonical SMILES for CID 59376423 is [CH]CC1CCOC(C)(C)O1.
What is the InChIKey of CID 59376423?
The InChIKey is KYZANWPEPRKHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-4-7-5-6-9-8(2,3)10-7/h1,7H,4-6H2,2-3H3.
What are the key properties of CID 59376423?
CID 59376423 has a molecular weight of 142.20 g/mol, XLogP of 1.63, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59376423 is sourced from PubChem (CID 59376423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).