2-cyclopropyl-3-hydroxybenzaldehyde

C10H10O2 — CID 88956363

IUPAC2-cyclopropyl-3-hydroxybenzaldehyde
SMILESO=Cc1cccc(O)c1C1CC1
InChIInChI=1S/C10H10O2/c11-6-8-2-1-3-9(12)10(8)7-4-5-7/h1-3,6-7,12H,4-5H2
InChIKeyOYNJDESAMNBGAS-UHFFFAOYSA-N
MW162.19 g/mol
LogP2.08
Rot. Bonds2

About 2-cyclopropyl-3-hydroxybenzaldehyde

2-cyclopropyl-3-hydroxybenzaldehyde (PubChem CID 88956363) has the molecular formula C10H10O2 and a molecular weight of 162.19 g/mol. Its IUPAC name is 2-cyclopropyl-3-hydroxybenzaldehyde.

Molecular Properties

Compound Name2-cyclopropyl-3-hydroxybenzaldehyde
PubChem CID88956363
Molecular FormulaC10H10O2
Molecular Weight162.19 g/mol
Exact Mass162.07
IUPAC Name2-cyclopropyl-3-hydroxybenzaldehyde
SMILESO=Cc1cccc(O)c1C1CC1
InChIInChI=1S/C10H10O2/c11-6-8-2-1-3-9(12)10(8)7-4-5-7/h1-3,6-7,12H,4-5H2
InChIKeyOYNJDESAMNBGAS-UHFFFAOYSA-N
XLogP2.08
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-hydroxybenzaldehyde?
The IUPAC name of 2-cyclopropyl-3-hydroxybenzaldehyde (CID 88956363) is 2-cyclopropyl-3-hydroxybenzaldehyde.
What is the SMILES notation for 2-cyclopropyl-3-hydroxybenzaldehyde?
The canonical SMILES for 2-cyclopropyl-3-hydroxybenzaldehyde is O=Cc1cccc(O)c1C1CC1.
What is the InChIKey of 2-cyclopropyl-3-hydroxybenzaldehyde?
The InChIKey is OYNJDESAMNBGAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O2/c11-6-8-2-1-3-9(12)10(8)7-4-5-7/h1-3,6-7,12H,4-5H2.
What are the key properties of 2-cyclopropyl-3-hydroxybenzaldehyde?
2-cyclopropyl-3-hydroxybenzaldehyde has a molecular weight of 162.19 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-hydroxybenzaldehyde is sourced from PubChem (CID 88956363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).