Baytan Universal
Basic information
- CAS
74725-94-3- Standard SMILES
CC(C)(C)C(O)C(Oc1ccc(Cl)cc1)n1cncn1.Cc1cc(C)n(-c2nc3ccccc3[nH]2)n1.c1coc(-c2nc3ccccc3[nH]2)c1- InChIKey
CMAMRCUPRGELDA-UHFFFAOYSA-N- Molecular formula
- C37H38ClN9O3
- Average molar mass
- 692.2 g/mol
- Monoisotopic mass
- 691.2786138
Names & identifiers
- Preferred name
- Baytan Universal
- IUPAC
- 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol;2-(3,5-dimethylpyrazol-1-yl)-1H-benzimidazole;2-(furan-2-yl)-1H-benzimidazole
- English name
- 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethy lethyl)-, mixt. with 2-(3,5-dimethyl-1H-pyrazol-1-yl)-1H-benzimidazole and 2-(2-furanyl)-1H-benzimidazole
- Molecular formula
- C37H38ClN9O3
- Molecular weight
- 692.20912
Names & synonyms
Baytan Universal74725-94-3DTXSID0013391591H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(3,5-dimethyl-1H-pyrazol-1-yl)-1H-benzimidazole and 2-(2-furanyl)-1H-benzimidazole1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethy lethyl)-, mixt. with 2-(3,5-dimethyl-1H-pyrazol-1-yl)-1H-benzimidazole and 2-(2-furanyl)-1H-benzimidazole
Database identifiers
- CAS
74725-94-3- PubChem CID
- 156306
- DTXSID
DTXSID001339159
Properties
Computed structural properties
- Topological polar surface area
- 148 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 50
- Formal charge
- 0
- Complexity
- 770
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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