Chemical Compound
4-Formyl-3-(methylsulfonyl)benzonitrile
CAS Registry Number1161921-93-2
Primary record
4-Formyl-3-(methylsulfonyl)benzonitrile
- CAS
- 1161921-93-2
- PubChem CID
- 58133750
- SMILES
- CS(=O)(=O)C1=C(C=CC(=C1)C#N)C=O
- Molecular Formula
- C9H7NO3S
- Molecular Weight
- 209.226
- Exact Mass
- 209.0147
- InChI
- InChI=1S/C9H7NO3S/c1-14(12,13)9-4-7(5-10)2-3-8(9)6-11/h2-4,6H,1H3
- InChIKey
- CVSWXEFIEBBKHH-UHFFFAOYSA-N
- LogP
- 0.7743
- TPSA
- 75
Names and synonyms
- 4-Formyl-3-(methylsulfonyl)benzonitrile
- 1161921-93-2
- C9H7NO3S
- SCHEMBL122510
- MFCD27941852
- 4-formyl-3-methylsulfonylbenzonitrile
- CVSWXEFIEBBKHH-UHFFFAOYSA-N
- 4-formyl-3-methanesulfonylbenzonitrile
- 4-formyl-3-methylsulfonyl-benzonitrile
- AT15108
- BS-46523
- DB-113323
- Benzonitrile, 4-formyl-3-(methylsulfonyl)-
- CS-0196524
- F633513
- A1247409