10-hydroxyphenanthrene-9-carbaldehyde

C15H10O2 — CID 3383009

IUPAC10-hydroxyphenanthrene-9-carbaldehyde
SMILESO=Cc1c(O)c2ccccc2c2ccccc12
InChIInChI=1S/C15H10O2/c16-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)15(14)17/h1-9,17H
InChIKeyAAUANTNCTLBCQX-UHFFFAOYSA-N
MW222.24 g/mol
LogP3.51
Rot. Bonds1

About 10-hydroxyphenanthrene-9-carbaldehyde

10-hydroxyphenanthrene-9-carbaldehyde (PubChem CID 3383009) has the molecular formula C15H10O2 and a molecular weight of 222.24 g/mol. Its IUPAC name is 10-hydroxyphenanthrene-9-carbaldehyde.

Molecular Properties

Compound Name10-hydroxyphenanthrene-9-carbaldehyde
PubChem CID3383009
Molecular FormulaC15H10O2
Molecular Weight222.24 g/mol
Exact Mass222.07
IUPAC Name10-hydroxyphenanthrene-9-carbaldehyde
SMILESO=Cc1c(O)c2ccccc2c2ccccc12
InChIInChI=1S/C15H10O2/c16-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)15(14)17/h1-9,17H
InChIKeyAAUANTNCTLBCQX-UHFFFAOYSA-N
XLogP3.51
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 10-hydroxyphenanthrene-9-carbaldehyde?
The IUPAC name of 10-hydroxyphenanthrene-9-carbaldehyde (CID 3383009) is 10-hydroxyphenanthrene-9-carbaldehyde.
What is the SMILES notation for 10-hydroxyphenanthrene-9-carbaldehyde?
The canonical SMILES for 10-hydroxyphenanthrene-9-carbaldehyde is O=Cc1c(O)c2ccccc2c2ccccc12.
What is the InChIKey of 10-hydroxyphenanthrene-9-carbaldehyde?
The InChIKey is AAUANTNCTLBCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10O2/c16-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)15(14)17/h1-9,17H.
What are the key properties of 10-hydroxyphenanthrene-9-carbaldehyde?
10-hydroxyphenanthrene-9-carbaldehyde has a molecular weight of 222.24 g/mol, XLogP of 3.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-hydroxyphenanthrene-9-carbaldehyde is sourced from PubChem (CID 3383009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).