propan-1-ol;toluene

C10H16O — CID 22495535

IUPACpropan-1-ol;toluene
SMILESCCCO.Cc1ccccc1
InChIInChI=1S/C7H8.C3H8O/c1-7-5-3-2-4-6-7;1-2-3-4/h2-6H,1H3;4H,2-3H2,1H3
InChIKeyOKDOZOFJAUITTD-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.38
Rot. Bonds1

About propan-1-ol;toluene

propan-1-ol;toluene (PubChem CID 22495535) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is propan-1-ol;toluene.

Molecular Properties

Compound Namepropan-1-ol;toluene
PubChem CID22495535
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Namepropan-1-ol;toluene
SMILESCCCO.Cc1ccccc1
InChIInChI=1S/C7H8.C3H8O/c1-7-5-3-2-4-6-7;1-2-3-4/h2-6H,1H3;4H,2-3H2,1H3
InChIKeyOKDOZOFJAUITTD-UHFFFAOYSA-N
XLogP2.38
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of propan-1-ol;toluene?
The IUPAC name of propan-1-ol;toluene (CID 22495535) is propan-1-ol;toluene.
What is the SMILES notation for propan-1-ol;toluene?
The canonical SMILES for propan-1-ol;toluene is CCCO.Cc1ccccc1.
What is the InChIKey of propan-1-ol;toluene?
The InChIKey is OKDOZOFJAUITTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8.C3H8O/c1-7-5-3-2-4-6-7;1-2-3-4/h2-6H,1H3;4H,2-3H2,1H3.
What are the key properties of propan-1-ol;toluene?
propan-1-ol;toluene has a molecular weight of 152.24 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for propan-1-ol;toluene is sourced from PubChem (CID 22495535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).