Basic information
- CAS
59263-66-0- Standard SMILES
Cc1ccc(N=CN(C)SN(C)C=Nc2ccc(C)cc2C)c(C)c1- InChIKey
GHNUBEGHGNEWIT-UHFFFAOYSA-N- Molecular formula
- C20H26N4S
- Average molar mass
- 354.5 g/mol
- Monoisotopic mass
- 354.18781802
Names & identifiers
- Preferred name
- N,N''-Thiobis(N-methyl-N'-2,4-xylylformamidine)
- IUPAC
- N'-(2,4-dimethylphenyl)-N-[(2,4-dimethylphenyl)iminomethyl-methylamino]sulfanyl-N-methylmethanimidamide
- English name
- 1,1'-Thiobis[(methylimino)methylidynenitrilo]bis(2,4-dimethylbenzene)
- Molecular formula
- C20H26N4S
- Molecular weight
- 354.51
Names & synonyms
N,N''-Thiobis(N-methyl-N'-2,4-xylylformamidine)59263-66-0DTXSID301031990RefChem:1090215DTXCID401516991U-44,193FORMAMIDINE, N,N''-THIOBIS(N-METHYL-N'-(2,4-XYLYL)-SCHEMBL11190565SCHEMBL11190568U-44193N1,N1'-Thiobis[N1-methyl-N2-(2,4-xylyl)formamidine]1,1'-Thiobis[(methylimino)methylidynenitrilo]bis(2,4-dimethylbenzene)
Show more names
Methanimidamide, N,N''-thiobis[N'-(2,4-dimethylphenyl)-N-methyl- (9CI)
Database identifiers
- CAS
59263-66-0- PubChem CID
- 42991
- DTXSID
DTXSID301031990- Nikkaji
- J11.198H
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 413
Physicochemical properties
- Boiling point
- 503.2 · 503.2±60.0 °C(Predicted)
- Density
- 1.04 · 1.04±0.1 g/cm3(Predicted)
- pka
- 4.62 · 4.62±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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