Basic information
- CAS
2374958-85-5- Standard SMILES
Cc1cccc(N2C[C@H](C(C)C)N=C2C2=N[C@@H](C(C)C)CN2c2cccc(C)c2)c1- InChIKey
BLRGOVDMCRPAKU-DNQXCXABSA-N- Molecular formula
- C26H34N4
- Average molar mass
- 402.6 g/mol
Names & identifiers
- Preferred name
- (4S,4'S)-4,4'-Diisopropyl-1,1'-di-m-tolyl-4,4',5,5'-tetrahydro-1H,1'H-2,2'-biimidazole
- IUPAC
- (4S)-1-(3-methylphenyl)-2-[(4S)-1-(3-methylphenyl)-4-propan-2-yl-4,5-dihydroimidazol-2-yl]-4-propan-2-yl-4,5-dihydroimidazole
- English name
- 2,2'-Bi-1H-imidazole, 4,4',5,5'-tetrahydro-4,4'-bis(1-methylethyl)-1,1'-bis(3-methylphenyl)-, (4S,4'S)-
- Molecular formula
- C26H34N4
- Molecular weight
- 402.58
Names & synonyms
(4S,4'S)-4,4'-Diisopropyl-1,1'-di-m-tolyl-4,4',5,5'-tetrahydro-1H,1'H-2,2'-biimidazole2374958-85-5MFCD34598722AS-86413CS-0436605F74322F764190(4S)-1-(3-methylphenyl)-2-[(4S)-1-(3-methylphenyl)-4-propan-2-yl-4,5-dihydroimidazol-2-yl]-4-propan-2-yl-4,5-dihydroimidazole(4S)-4-isopropyl-2-[(4S)-4-isopropyl-1-(m-tolyl)-4,5-dihydroimidazol-2-yl]-1-(m-tolyl)-4,5-dihydroimidazole(4S,4'S)-4,4'-Diisopropyl-1,1'-di-m-tolyl-4,4',5,5'-tetrahydro-1H,1'H-2,2'-biimidazole - [D90012]2,2'-Bi-1H-imidazole, 4,4',5,5'-tetrahydro-4,4'-bis(1-methylethyl)-1,1'-bis(3-methylphenyl)-, (4S,4'S)-
Database identifiers
- CAS
2374958-85-5
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 31.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 595
Physicochemical properties
- Boiling point
- 530.1 · 530.1±53.0 °C(Predicted)
- Density
- 1.11 · 1.11±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, stored under nitrogen
- pka
- 7.82 · 7.82±0.70(Predicted)
- Appearance
- White to off-white Solid
Chemistry & industry
Suppliers11 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海凯米莱铂生物科技有限公司18116465878 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海瀚思化工有限公司18916268197 · [email protected]
上海安屹诺生物医药科技有限公司021-34625901 · [email protected]
Aladdin Scientific[email protected]
安徽英纳威迅科技有限公司0551-62106121 13625641131 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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