CID 11087023

C9H9O — CID 11087023

IUPAC—
SMILESO[CH]C=Cc1ccccc1
InChIInChI=1S/C9H9O/c10-8-4-7-9-5-2-1-3-6-9/h1-8,10H
InChIKeyCAAHGXGXTQBHFR-UHFFFAOYSA-N
MW133.17 g/mol
LogP2.23
Rot. Bonds2

About CID 11087023

CID 11087023 (PubChem CID 11087023) has the molecular formula C9H9O and a molecular weight of 133.17 g/mol.

Molecular Properties

Compound NameCID 11087023
PubChem CID11087023
Molecular FormulaC9H9O
Molecular Weight133.17 g/mol
Exact Mass133.07
IUPAC Name—
SMILESO[CH]C=Cc1ccccc1
InChIInChI=1S/C9H9O/c10-8-4-7-9-5-2-1-3-6-9/h1-8,10H
InChIKeyCAAHGXGXTQBHFR-UHFFFAOYSA-N
XLogP2.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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4-methylpenta-1,3-dienylbenzene
CID 3614395
CID 70567885
CID 70567885
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CID 70569152
(1Z,3Z,6Z,8E)-1,9-diphenylnona-1,3,6,8-tetraen-5-one
CID 51568438
(1E,3E,7E,9E)-1,10-diphenyldeca-1,3,7,9-tetraene-5,6-dione
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Frequently Asked Questions

What is the IUPAC name of CID 11087023?
The IUPAC name of CID 11087023 (CID 11087023) is not available.
What is the SMILES notation for CID 11087023?
The canonical SMILES for CID 11087023 is O[CH]C=Cc1ccccc1.
What is the InChIKey of CID 11087023?
The InChIKey is CAAHGXGXTQBHFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9O/c10-8-4-7-9-5-2-1-3-6-9/h1-8,10H.
What are the key properties of CID 11087023?
CID 11087023 has a molecular weight of 133.17 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11087023 is sourced from PubChem (CID 11087023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).