Basic information
- CAS
63388-01-2- Standard SMILES
O=c1[nH]c2ccccc2n1CCO- InChIKey
ZONXBNQBUCKCLU-UHFFFAOYSA-N- Molecular formula
- C9H10N2O2
- Average molar mass
- 178.19 g/mol
- Monoisotopic mass
- 178.07422757
Names & identifiers
- Preferred name
- 1-(2-Hydroxyethyl)-1H-benzo[d]imidazol-2(3H)-one
- IUPAC
- 3-(2-hydroxyethyl)-1H-benzimidazol-2-one
- English name
- 1-(2-Chloroethyl)-2,3-dihydrobenzimidazol-2-one
- Molecular formula
- C9H10N2O2
- Molecular weight
- 178.19
Names & synonyms
63388-01-21-(2-Hydroxyethyl)-1H-benzo[d]imidazol-2(3H)-one3-(2-hydroxyethyl)-1H-benzimidazol-2-one2-Hydroxyethylbenzimidazolidinone-21,3-Dihydro-1-(2-hydroxyethyl)-2H-benzimidazol-2-one1-(2-Hydroxyethyl)-1,3-dihydro-2H-benzimidazol-2-one2H-Benzimidazol-2-one, 1,3-dihydro-1-(2-hydroxyethyl)-MFCD022712171-(2-Hydroxyethyl)-1,3-dihydro-2H-benzo[d]imidazol-2-one1-(2-Hydroxy-ethyl)-1,3-dihydro-benzoimidazol-2-onebenzimidazole-2-oneSCHEMBL763166
Show more names
2H-BENZIMIDAZOL-2-ONE2-BENZIMIDAZOLINONE,1-(2-HYDROXYETHYL)2H-Benzimidazol-2-one,1,3-dihydro-1-(2-hydroxyethyl)-(9CI)
SCHEMBL24259672H-Benzimidazol-2-one,1,3-dihydro-1-(2-hydroxyethyl)-DTXSID204000481-(2-hydroxyethyl)benzimidazoloneZONXBNQBUCKCLU-UHFFFAOYSA-NAKOS000301133SY490271DB-049941
Database identifiers
- CAS
63388-01-2- PubChem CID
- 4157423
- DTXSID
DTXSID20400048
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 208
Physicochemical properties
- Melting point
- 140 · 140-142°C
- Density
- 1.298 · 1.298±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Acetonitrile (Slightly), DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 11.92 · 11.92±0.30(Predicted)
- color
- Off-White to Light Beige
- CAS DataBase Reference
- 63388 · 63388-01-2(CAS DataBase Reference)
- HazardClass
- IRRITANT
Safety & regulation
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers15 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
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Related reactions
3 records
Compound notes
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