4-(2-hydroxyphenoxy)benzaldehyde

C13H10O3 — CID 13266147

IUPAC4-(2-hydroxyphenoxy)benzaldehyde
SMILESO=Cc1ccc(Oc2ccccc2O)cc1
InChIInChI=1S/C13H10O3/c14-9-10-5-7-11(8-6-10)16-13-4-2-1-3-12(13)15/h1-9,15H
InChIKeyLDHLQYLWQRPKLT-UHFFFAOYSA-N
MW214.22 g/mol
LogP3.00
Rot. Bonds3

About 4-(2-hydroxyphenoxy)benzaldehyde

4-(2-hydroxyphenoxy)benzaldehyde (PubChem CID 13266147) has the molecular formula C13H10O3 and a molecular weight of 214.22 g/mol. Its IUPAC name is 4-(2-hydroxyphenoxy)benzaldehyde.

Molecular Properties

Compound Name4-(2-hydroxyphenoxy)benzaldehyde
PubChem CID13266147
Molecular FormulaC13H10O3
Molecular Weight214.22 g/mol
Exact Mass214.06
IUPAC Name4-(2-hydroxyphenoxy)benzaldehyde
SMILESO=Cc1ccc(Oc2ccccc2O)cc1
InChIInChI=1S/C13H10O3/c14-9-10-5-7-11(8-6-10)16-13-4-2-1-3-12(13)15/h1-9,15H
InChIKeyLDHLQYLWQRPKLT-UHFFFAOYSA-N
XLogP3.00
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(4-formylphenoxy)benzoic acid
CID 19374993
N-[4-(2-hydroxyphenoxy)phenyl]formamide
CID 87704092
4-naphthalen-1-yloxybenzaldehyde
CID 19069208
2-(4-methoxyphenoxy)phenol
CID 54145402
2-(4-iodophenoxy)phenol
CID 90870706
4-hydroxy-3,5-diphenoxybenzaldehyde
CID 101190258
2-[6-(2-hydroxyphenoxy)naphthalen-2-yl]oxyphenol
CID 175775609
4-(4-fluorophenoxy)benzaldehyde
CID 3856802
4-(1-benzothiophen-3-yloxy)benzaldehyde
CID 11265291
2-[4-(trifluoromethoxy)phenoxy]phenol
CID 19755907
2-[4-(2-phenylethenyl)phenoxy]benzaldehyde
CID 57248486
1,2-dimethoxybenzene;4-hydroxy-3-methoxybenzaldehyde
CID 175414068

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxyphenoxy)benzaldehyde?
The IUPAC name of 4-(2-hydroxyphenoxy)benzaldehyde (CID 13266147) is 4-(2-hydroxyphenoxy)benzaldehyde.
What is the SMILES notation for 4-(2-hydroxyphenoxy)benzaldehyde?
The canonical SMILES for 4-(2-hydroxyphenoxy)benzaldehyde is O=Cc1ccc(Oc2ccccc2O)cc1.
What is the InChIKey of 4-(2-hydroxyphenoxy)benzaldehyde?
The InChIKey is LDHLQYLWQRPKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O3/c14-9-10-5-7-11(8-6-10)16-13-4-2-1-3-12(13)15/h1-9,15H.
What are the key properties of 4-(2-hydroxyphenoxy)benzaldehyde?
4-(2-hydroxyphenoxy)benzaldehyde has a molecular weight of 214.22 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxyphenoxy)benzaldehyde is sourced from PubChem (CID 13266147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).