4-(2,3-Dihydroimidazo[2,1-b][1,3]thiazol-6-yl)aniline
Basic information
- CAS
4335-34-6- Standard SMILES
Nc1ccc(-c2cn3c(n2)SCC3)cc1- InChIKey
JYDVTSQQZMZVDH-UHFFFAOYSA-N- Molecular formula
- C11H11N3S
- Average molar mass
- 217.29 g/mol
- Monoisotopic mass
- 217.06736854
Names & identifiers
- Preferred name
- 4-(2,3-Dihydroimidazo[2,1-b][1,3]thiazol-6-yl)aniline
- IUPAC
- 4-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)aniline
- English name
- 4-(2,3-Dihydroimidazo[2,1-b][1,3]thiazol-6-yl)aniline
- Molecular formula
- C11H11N3S
- Molecular weight
- 217.29
Names & synonyms
4335-34-64-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)aniline4-(2,3-Dihydroimidazo[2,1-b]thiazol-6-yl)anilineMFCD026780604-{2H,3H-imidazo[2,1-b][1,3]thiazol-6-yl}aniline[4-(2,3-dihydroimidazo[2,1-{b}][1,3]thiazol-6-yl)phenyl]amineMaybridge3_002555Oprea1_479814SCHEMBL9744176Benzenamine,4-(2,3-dihydroimidazo[2,1-b]thiazol-6-yl)-DTXSID60380653HMS1438E03
Show more names
Benzenamine, 4-(2,3-dihydroimidazo[2,1-b]thiazol-6-yl)-4-(2,3-Dihydroimidazo[2,1-b][1,3]thiazol-6-yl)aniline , Tech.
NSC741781SBB095456AKOS005135900CCG-242240NSC-741781SDCCGMLS-0066111.P001IDI1_013942DB-070426
Database identifiers
- CAS
4335-34-6- PubChem CID
- 2777784
- DTXSID
DTXSID60380653
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 228
Physicochemical properties
- Melting point
- 223 · 223-225°C
- Boiling point
- 472.2 · 472.2±37.0 °C(Predicted)
- Density
- 1.43 · 1.43±0.1 g/cm3(Predicted)
- pka
- 5.95 · 5.95±0.20(Predicted)
- Risk Statements
- 20 · 20/21/22
- Safety Statements
- 22 · 22-36/37/39
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- risk_code
- 20/21/22
- safety_code
- 22-36/37/39
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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