CID 11170996

C9H9O — CID 11170996

IUPAC—
SMILES[2H]C1([O])CCc2ccccc21
InChIInChI=1S/C9H9O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9H,5-6H2/i9D
InChIKeyUIXGLUKQEQQDKU-QOWOAITPSA-N
MW134.18 g/mol
LogP2.10
Rot. Bonds

About CID 11170996

CID 11170996 (PubChem CID 11170996) has the molecular formula C9H9O and a molecular weight of 134.18 g/mol.

Molecular Properties

Compound NameCID 11170996
PubChem CID11170996
Molecular FormulaC9H9O
Molecular Weight134.18 g/mol
Exact Mass134.07
IUPAC Name—
SMILES[2H]C1([O])CCc2ccccc21
InChIInChI=1S/C9H9O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9H,5-6H2/i9D
InChIKeyUIXGLUKQEQQDKU-QOWOAITPSA-N
XLogP2.10
TPSA19.90 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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2-[(1R)-2,3-dihydro-1H-inden-1-yl]phenol
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cadmium;bis(2,3-dihydro-1H-indene-1-carboxylic acid)
CID 162540344
2,3-dihydro-1H-inden-1-amine;methanamine
CID 174570832
[(1S)-2,3-dihydro-1H-inden-1-yl]-trimethylazanium
CID 57317290
1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene
CID 156649341
tris(2,3-dihydro-1H-inden-1-ol);ethane
CID 19770523
sodium 2,3-dihydro-1H-indene-1-sulfinate
CID 139624777
1,1-bis[(1R)-2,3-dihydro-1H-inden-1-yl]pyrrolidin-1-ium-2,5-dione
CID 87920205
1-ethyl-2,3-dihydro-1H-indene
CID 20971
(1S)-1-cyclopentyl-2,3-dihydro-1H-indene
CID 134946753
(1R)-1-propan-2-yl-2,3-dihydro-1H-indene
CID 59961726

Frequently Asked Questions

What is the IUPAC name of CID 11170996?
The IUPAC name of CID 11170996 (CID 11170996) is not available.
What is the SMILES notation for CID 11170996?
The canonical SMILES for CID 11170996 is [2H]C1([O])CCc2ccccc21.
What is the InChIKey of CID 11170996?
The InChIKey is UIXGLUKQEQQDKU-QOWOAITPSA-N. The full InChI is InChI=1S/C9H9O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9H,5-6H2/i9D.
What are the key properties of CID 11170996?
CID 11170996 has a molecular weight of 134.18 g/mol, XLogP of 2.10, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11170996 is sourced from PubChem (CID 11170996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).