4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde

C13H8Cl2O2 — CID 145048893

IUPAC4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde
SMILESO=Cc1cc(-c2ccccc2Cl)c(Cl)cc1O
InChIInChI=1S/C13H8Cl2O2/c14-11-4-2-1-3-9(11)10-5-8(7-16)13(17)6-12(10)15/h1-7,17H
InChIKeyBGUUWCMRLCZDFQ-UHFFFAOYSA-N
MW267.11 g/mol
LogP4.18
Rot. Bonds2

About 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde

4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde (PubChem CID 145048893) has the molecular formula C13H8Cl2O2 and a molecular weight of 267.11 g/mol. Its IUPAC name is 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde.

Molecular Properties

Compound Name4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde
PubChem CID145048893
Molecular FormulaC13H8Cl2O2
Molecular Weight267.11 g/mol
Exact Mass265.99
IUPAC Name4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde
SMILESO=Cc1cc(-c2ccccc2Cl)c(Cl)cc1O
InChIInChI=1S/C13H8Cl2O2/c14-11-4-2-1-3-9(11)10-5-8(7-16)13(17)6-12(10)15/h1-7,17H
InChIKeyBGUUWCMRLCZDFQ-UHFFFAOYSA-N
XLogP4.18
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.11
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde;(E)-4-(dimethylamino)-1-(4-methylpiperazin-1-yl)but-2-en-1-one
CID 145048892
4-chloro-6-hydroxybenzene-1,3-dicarbaldehyde
CID 177311411
2-(2,5-dichlorophenyl)benzaldehyde
CID 58037863
azane;4-chloro-2-hydroxybenzaldehyde;formaldehyde
CID 161490550
4-(2,5-dichlorophenyl)-2-hydroxybenzaldehyde
CID 53220552
5-(2,5-dichlorophenyl)-2-hydroxybenzaldehyde
CID 53220551
5-(2,6-dichlorophenyl)-2-hydroxybenzaldehyde
CID 122358686
5-(2-chlorophenyl)-2-hydroxy-3-methoxybenzaldehyde
CID 39224803
2-(2-hydroxyphenyl)benzaldehyde
CID 15593934
2,5-dichloro-4-hydroxybenzaldehyde
CID 528381
2,4-dichloro-5-(2-chlorophenyl)benzoyl chloride
CID 118010558
5-bromo-2-(2-chlorophenyl)-4-methoxybenzaldehyde
CID 87697435

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde?
The IUPAC name of 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde (CID 145048893) is 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde.
What is the SMILES notation for 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde?
The canonical SMILES for 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde is O=Cc1cc(-c2ccccc2Cl)c(Cl)cc1O.
What is the InChIKey of 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde?
The InChIKey is BGUUWCMRLCZDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2O2/c14-11-4-2-1-3-9(11)10-5-8(7-16)13(17)6-12(10)15/h1-7,17H.
What are the key properties of 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde?
4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde has a molecular weight of 267.11 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-(2-chlorophenyl)-2-hydroxybenzaldehyde is sourced from PubChem (CID 145048893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).