CID 59201849

C9H10 — CID 59201849

IUPAC—
SMILES[CH]Cc1cccc(C)c1
InChIInChI=1S/C9H10/c1-3-9-6-4-5-8(2)7-9/h1,4-7H,3H2,2H3
InChIKeyXVXILULBJIHNQE-UHFFFAOYSA-N
MW118.18 g/mol
LogP2.25
Rot. Bonds1

About CID 59201849

CID 59201849 (PubChem CID 59201849) has the molecular formula C9H10 and a molecular weight of 118.18 g/mol.

Molecular Properties

Compound NameCID 59201849
PubChem CID59201849
Molecular FormulaC9H10
Molecular Weight118.18 g/mol
Exact Mass118.08
IUPAC Name—
SMILES[CH]Cc1cccc(C)c1
InChIInChI=1S/C9H10/c1-3-9-6-4-5-8(2)7-9/h1,4-7H,3H2,2H3
InChIKeyXVXILULBJIHNQE-UHFFFAOYSA-N
XLogP2.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.18
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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1-bromo-4-[(3-methylphenyl)methyl]benzene
CID 67156138
ethane;1-ethyl-3-methylbenzene;methane;propane
CID 161003738
2-(3-methylphenyl)ethanolate
CID 142208639
1-(2,2-dimethylbut-3-ynyl)-3-methylbenzene
CID 122240116
2-(3-methylphenyl)ethanamine;hydrochloride
CID 47003273

Frequently Asked Questions

What is the IUPAC name of CID 59201849?
The IUPAC name of CID 59201849 (CID 59201849) is not available.
What is the SMILES notation for CID 59201849?
The canonical SMILES for CID 59201849 is [CH]Cc1cccc(C)c1.
What is the InChIKey of CID 59201849?
The InChIKey is XVXILULBJIHNQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10/c1-3-9-6-4-5-8(2)7-9/h1,4-7H,3H2,2H3.
What are the key properties of CID 59201849?
CID 59201849 has a molecular weight of 118.18 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59201849 is sourced from PubChem (CID 59201849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).