CID 102368256

C9H13O — CID 102368256

IUPAC—
SMILESC[C]1C=CC(C)=CC1(C)O
InChIInChI=1S/C9H13O/c1-7-4-5-8(2)9(3,10)6-7/h4-6,10H,1-3H3
InChIKeyWOFGXBNOAHTYLZ-UHFFFAOYSA-N
MW137.20 g/mol
LogP1.85
Rot. Bonds

About CID 102368256

CID 102368256 (PubChem CID 102368256) has the molecular formula C9H13O and a molecular weight of 137.20 g/mol.

Molecular Properties

Compound NameCID 102368256
PubChem CID102368256
Molecular FormulaC9H13O
Molecular Weight137.20 g/mol
Exact Mass137.10
IUPAC Name—
SMILESC[C]1C=CC(C)=CC1(C)O
InChIInChI=1S/C9H13O/c1-7-4-5-8(2)9(3,10)6-7/h4-6,10H,1-3H3
InChIKeyWOFGXBNOAHTYLZ-UHFFFAOYSA-N
XLogP1.85
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.20
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 102368256?
The IUPAC name of CID 102368256 (CID 102368256) is not available.
What is the SMILES notation for CID 102368256?
The canonical SMILES for CID 102368256 is C[C]1C=CC(C)=CC1(C)O.
What is the InChIKey of CID 102368256?
The InChIKey is WOFGXBNOAHTYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13O/c1-7-4-5-8(2)9(3,10)6-7/h4-6,10H,1-3H3.
What are the key properties of CID 102368256?
CID 102368256 has a molecular weight of 137.20 g/mol, XLogP of 1.85, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102368256 is sourced from PubChem (CID 102368256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).