Basic information
- CAS
47003-30-5- Standard SMILES
CSc1cc(Cc2ccc(N)c(SC)c2)ccc1N- InChIKey
XRKGCGRPZUUQRR-UHFFFAOYSA-N- Molecular formula
- C15H18N2S2
- Average molar mass
- 290.5 g/mol
- Monoisotopic mass
- 290.09114093
Names & identifiers
- Preferred name
- 4,4'-Methylenebis(2-(methylthio)aniline)
- IUPAC
- 4-[(4-amino-3-methylsulfanylphenyl)methyl]-2-methylsulfanylaniline
- English name
- 4,4'-methylenebis[2-(methylthio)aniline]
- Molecular formula
- C15H18N2S2
- Molecular weight
- 290.44682
Names & synonyms
47003-30-54,4'-Methylenebis(2-(methylthio)aniline)EINECS 256-291-1Z28GJL6G8NSCHEMBL10943765DTXSID20197002XRKGCGRPZUUQRR-UHFFFAOYSA-NNS000316554,4'-Methylenebis[2-(methylsulfanyl)aniline]4,4'-methylenebis[2-(methylthio)aniline]
Database identifiers
- CAS
47003-30-5- PubChem CID
- 6452074
- DTXSID
DTXSID20197002- UNII
- Z28GJL6G8N
- EC Number
- 256-291-1
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 249
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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