CID 10775933

C14H16O3 — CID 10775933

IUPAC—
SMILESCC1=C2C=CC=C2C(O)C2(OCCO2)C12CC2
InChIInChI=1S/C14H16O3/c1-9-10-3-2-4-11(10)12(15)14(13(9)5-6-13)16-7-8-17-14/h2-4,12,15H,5-8H2,1H3
InChIKeyCAXAMDBERBDPLF-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.70
Rot. Bonds

About CID 10775933

CID 10775933 (PubChem CID 10775933) has the molecular formula C14H16O3 and a molecular weight of 232.28 g/mol.

Molecular Properties

Compound NameCID 10775933
PubChem CID10775933
Molecular FormulaC14H16O3
Molecular Weight232.28 g/mol
Exact Mass232.11
IUPAC Name—
SMILESCC1=C2C=CC=C2C(O)C2(OCCO2)C12CC2
InChIInChI=1S/C14H16O3/c1-9-10-3-2-4-11(10)12(15)14(13(9)5-6-13)16-7-8-17-14/h2-4,12,15H,5-8H2,1H3
InChIKeyCAXAMDBERBDPLF-UHFFFAOYSA-N
XLogP1.70
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 10775933?
The IUPAC name of CID 10775933 (CID 10775933) is not available.
What is the SMILES notation for CID 10775933?
The canonical SMILES for CID 10775933 is CC1=C2C=CC=C2C(O)C2(OCCO2)C12CC2.
What is the InChIKey of CID 10775933?
The InChIKey is CAXAMDBERBDPLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O3/c1-9-10-3-2-4-11(10)12(15)14(13(9)5-6-13)16-7-8-17-14/h2-4,12,15H,5-8H2,1H3.
What are the key properties of CID 10775933?
CID 10775933 has a molecular weight of 232.28 g/mol, XLogP of 1.70, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10775933 is sourced from PubChem (CID 10775933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).