CID 66734377

C14H14KO — CID 66734377

IUPAC—
SMILES[K].c1ccc(COCc2ccccc2)cc1
InChIInChI=1S/C14H14O.K/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;/h1-10H,11-12H2;
InChIKeyLDIPVKABLDWRGC-UHFFFAOYSA-N
MW237.36 g/mol
LogP3.02
Rot. Bonds4

About CID 66734377

CID 66734377 (PubChem CID 66734377) has the molecular formula C14H14KO and a molecular weight of 237.36 g/mol.

Molecular Properties

Compound NameCID 66734377
PubChem CID66734377
Molecular FormulaC14H14KO
Molecular Weight237.36 g/mol
Exact Mass237.07
IUPAC Name—
SMILES[K].c1ccc(COCc2ccccc2)cc1
InChIInChI=1S/C14H14O.K/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;/h1-10H,11-12H2;
InChIKeyLDIPVKABLDWRGC-UHFFFAOYSA-N
XLogP3.02
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.36
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 123410479
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CID 87947851
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CID 70513406
butane;phenol;phenylmethoxymethylbenzene
CID 174556357
[2-(phenylmethoxymethyl)phenyl]methanol
CID 54193166

Frequently Asked Questions

What is the IUPAC name of CID 66734377?
The IUPAC name of CID 66734377 (CID 66734377) is not available.
What is the SMILES notation for CID 66734377?
The canonical SMILES for CID 66734377 is [K].c1ccc(COCc2ccccc2)cc1.
What is the InChIKey of CID 66734377?
The InChIKey is LDIPVKABLDWRGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O.K/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;/h1-10H,11-12H2;.
What are the key properties of CID 66734377?
CID 66734377 has a molecular weight of 237.36 g/mol, XLogP of 3.02, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66734377 is sourced from PubChem (CID 66734377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).