2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde

C14H10Cl2O2 — CID 60791930

IUPAC2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde
SMILESO=Cc1c(Cl)cccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C14H10Cl2O2/c15-11-6-4-10(5-7-11)9-18-14-3-1-2-13(16)12(14)8-17/h1-8H,9H2
InChIKeyMRISNZKKKGMGGC-UHFFFAOYSA-N
MW281.14 g/mol
LogP4.38
Rot. Bonds4

About 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde

2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde (PubChem CID 60791930) has the molecular formula C14H10Cl2O2 and a molecular weight of 281.14 g/mol. Its IUPAC name is 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde.

Molecular Properties

Compound Name2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde
PubChem CID60791930
Molecular FormulaC14H10Cl2O2
Molecular Weight281.14 g/mol
Exact Mass280.01
IUPAC Name2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde
SMILESO=Cc1c(Cl)cccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C14H10Cl2O2/c15-11-6-4-10(5-7-11)9-18-14-3-1-2-13(16)12(14)8-17/h1-8H,9H2
InChIKeyMRISNZKKKGMGGC-UHFFFAOYSA-N
XLogP4.38
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.14
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-6-[(3,4-dimethoxyphenyl)methoxy]benzaldehyde
CID 60790504
2-chloro-6-(4-methoxybutoxy)benzaldehyde
CID 104647699
2-chloro-6-(2-phenoxyethoxy)benzaldehyde
CID 28603977
3-chloro-4-[(4-chlorophenyl)methoxy]benzaldehyde
CID 818787
2-(3,5-dichlorophenyl)-6-phenylmethoxybenzaldehyde
CID 172993959
tert-butyl 2-[3-[(3-chloro-2-formylphenoxy)methyl]phenyl]acetate
CID 167532262
2-chloro-6-heptoxybenzaldehyde
CID 45282902
2-chloro-6-(2-ethylsulfonylethoxy)benzaldehyde
CID 60790501
2-chloro-6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzaldehyde
CID 54919221
2-[(4-chlorophenyl)methoxy]-3-methoxybenzaldehyde
CID 889254
N-[[2-chloro-6-[(4-chlorophenyl)methoxy]phenyl]methyl]ethanamine
CID 114319059
2-chloro-6-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]benzaldehyde
CID 60792234

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde?
The IUPAC name of 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde (CID 60791930) is 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde.
What is the SMILES notation for 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde?
The canonical SMILES for 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde is O=Cc1c(Cl)cccc1OCc1ccc(Cl)cc1.
What is the InChIKey of 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde?
The InChIKey is MRISNZKKKGMGGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2O2/c15-11-6-4-10(5-7-11)9-18-14-3-1-2-13(16)12(14)8-17/h1-8H,9H2.
What are the key properties of 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde?
2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde has a molecular weight of 281.14 g/mol, XLogP of 4.38, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[(4-chlorophenyl)methoxy]benzaldehyde is sourced from PubChem (CID 60791930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).