Basic information
- CAS
54306-15-9- Standard SMILES
Cc1ccc(S(=O)(=O)Cc2ccc(N)cc2)cc1- InChIKey
PAZPBJJIOPGWOO-UHFFFAOYSA-N- Molecular formula
- C14H15NO2S
- Average molar mass
- 261.34 g/mol
- Monoisotopic mass
- 261.08234972
Names & identifiers
- Preferred name
- 4-[[(4-Methylphenyl)sulfonyl]methyl]benzenamine
- IUPAC
- 4-[(4-methylphenyl)sulfonylmethyl]aniline
- English name
- 4-[(4-Methylbenzenesulfonyl)Methyl]aniline
- Molecular formula
- C14H15NO2S
- Molecular weight
- 261.3394
Names & synonyms
54306-15-94-[[(4-Methylphenyl)sulfonyl]methyl]benzenamine4-(((4-Methylphenyl)sulfonyl)methyl)benzenamineRefChem:2862454-(Tosylmethyl)aniline(4-{[(4-methylphenyl)sulfonyl]methyl}phenyl)amine4-{[(4-methylphenyl)sulfonyl]methyl}anilineMFCD05857299(4-([(4-Methylphenyl)sulfonyl]methyl)phenyl)amine4-[(4-METHYLBENZENESULFONYL)METHYL]ANILINE(4-[[(4-METHYLPHENYL)SULFONYL]METHYL]PHENYL)AMINE4-[(4-methylphenyl)sulfonylmethyl]aniline
Show more names
1-{[(4-aminophenyl)methyl]sulfonyl}-4-methylbenzeneBenzenamine, 4-[[(4-methylphenyl)sulfonyl]methyl]-SCHEMBL33813664-(p-tolylsulfonylmethyl)anilineDTXSID501240628HMS1605B19ALBB-0252574-aminobenzyl 4-methylphenyl sulfone
Database identifiers
- CAS
54306-15-9- PubChem CID
- 1508418
- DTXSID
DTXSID501240628
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 344
Chemistry & industry
Suppliers1 total
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
5 records
Compound notes
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