C1=CC(=C(C=C1Cl)Cl)C=O
CAS: 874-42-0
Name: 2,4-dichlorobenzaldehyde
SMILES: C1=CC(=C(C=C1Cl)Cl)C=O

Molecular Processing

Molecular formula
C7H4Cl2O
Molecular weight
175.01
Exact mass
173.9639
XLogP
2.81
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
41.85

Supplementary Information

InChIKey: YSFBEAASFUWWHU-UHFFFAOYSA-N
Synonyme
2,4-DICHLOROBENZALDEHYDE874-42-0Benzaldehyde, 2,4-dichloro-CCRIS 6013DTXSID1022130NSC 8762EINECS 212-861-1UNII-Z08QL2124RAI3-16063Z08QL2124RNSC-8762DTXCID302130O,P-DICHLOROBENZALDEHYDEDICHLOROBENZALDEHYDE, 2,4-2,4-DICHLOROPHENYLCARBOXALDEHYDERefChem:82375212-861-1InChI=1/C7H4Cl2O/c8-6-2-1-5(4-10)7(9)3-6/h1-4YSFBEAASFUWWHU-UHFFFAOYSA-N2,4-dichloro-benzaldehydeMFCD00003305NSC87622,4-Dichlorobenzaldehyde; 2,4-Dichlorophenylcarboxaldehyde; NSC 8762; o,p-DichlorobenzaldehydeMiconazole Impurity 192,4 dichloro benzaldehyde2,4-di-chlorobenzaldehydeSCHEMBL95434SCHEMBL95435SCHEMBL8085506CHEMBL1531235
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