C1=CC(=CC=C1C=O)C(=O)O
CAS: 619-66-9
Name: 4-formylbenzoic acid
SMILES: C1=CC(=CC=C1C=O)C(=O)O

Molecular Processing

Molecular formula
C8H6O3
Molecular weight
150.13
Exact mass
150.0317
XLogP
1.2
TPSA
54.37
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
11
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
38.79

Supplementary Information

InChIKey: GOUHYARYYWKXHS-UHFFFAOYSA-N
Synonyme
4-FORMYLBENZOIC ACID619-66-94-Carboxybenzaldehydep-Carboxybenzaldehyde4-Carboxybenzaladehydepara-carboxybenzaldehydeRefChem:523544Terephthalaldehydic acidBenzoic acid, 4-formyl-p-Formylbenzoic acidTerephthaldehydic acidMFCD000069514-Formyl-benzoic acidDTXSID3027249p-benzoic acid aldehydeUES4QRK36E4-CARBOXYLBENZALDEHYDENSC-157974-FormylbenzoicAcid4-formyl benzoic acidHSDB 5719EINECS 210-607-4UNII-UES4QRK36ENSC 15797BRN 0471734Benzaldehyde-4-carboxylic acid4carboxybenzaldehyde4-carboxybenzaldehyd4formyl-benzoic acid4-carboxy benzaldehyde
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