ethyl 2-{[6-chloro-2-(4-methylphenyl)-1H-1,3-benzimidazol-1-yl]oxy}propanoate
Basic information
- CAS
282523-55-1- Standard SMILES
CCOC(=O)C(C)On1c(-c2ccc(C)cc2)nc2ccc(Cl)cc21- InChIKey
QWXZCMQCCIDNII-UHFFFAOYSA-N- Molecular formula
- C19H19ClN2O3
- Average molar mass
- 358.8 g/mol
Names & identifiers
- Preferred name
- ethyl 2-{[6-chloro-2-(4-methylphenyl)-1H-1,3-benzimidazol-1-yl]oxy}propanoate
- IUPAC
- ethyl 2-[6-chloro-2-(4-methylphenyl)benzimidazol-1-yl]oxypropanoate
- English name
- Ethyl 2-([6-chloro-2-(4-methylphenyl)-1H-1,3-benzimidazol-1-yl]oxy)propanoate
- Molecular formula
- C19H19ClN2O3
- Molecular weight
- 358.82
Names & synonyms
282523-55-1ethyl 2-{[6-chloro-2-(4-methylphenyl)-1H-1,3-benzimidazol-1-yl]oxy}propanoateethyl 2-[6-chloro-2-(4-methylphenyl)benzimidazol-1-yl]oxypropanoateMFCD00141420ethyl 2-{[6-chloro-2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]oxy}propanoateOprea1_173664AKOS00507440110F-393Sethyl 2-[6-chloro-2-(p-tolyl)benzimidazol-1-yl]oxypropanoateethyl2-{[6-chloro-2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]oxy}propanoateEthyl 2-([6-chloro-2-(4-methylphenyl)-1H-1,3-benzimidazol-1-yl]oxy)propanoatePropanoic acid, 2-[[6-chloro-2-(4-methylphenyl)-1H-benzimidazol-1-yl]oxy]-, ethyl ester
Database identifiers
- CAS
282523-55-1
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 456
Physicochemical properties
- Boiling point
- 488.4 · 488.4±55.0 °C(Predicted)
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- pka
- 2.02 · 2.02±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
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Compound notes
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