Basic information
- CAS
890094-09-4- Standard SMILES
O=C(O)c1ccc2c(c1)ncn2CCO- InChIKey
CFHXBUHAAVSOHD-UHFFFAOYSA-N- Molecular formula
- C10H10N2O3
- Average molar mass
- 206.2 g/mol
- Monoisotopic mass
- 206.06914219
Names & identifiers
- Preferred name
- 1-(2-Hydroxyethyl)-1H-benzimidazole-5-carboxylic acid
- IUPAC
- 1-(2-hydroxyethyl)benzimidazole-5-carboxylic acid
- English name
- 1-(2-hydroxyethyl)-1H-benzimidazole-5-carboxylic acid(SALTDATA: FREE)
- Molecular formula
- C10H10N2O3
- Molecular weight
- 206.2
Names & synonyms
1-(2-Hydroxyethyl)-1H-benzimidazole-5-carboxylic acid890094-09-4DTXSID70409460RefChem:223548DTXCID403603121-(2-hydroxyethyl)benzimidazole-5-carboxylic acid1-(2-Hydroxyethyl)-1H-benzo[d]imidazole-5-carboxylic acid1-(2-hydroxyethyl)-1H-1,3-benzodiazole-5-carboxylic acidSCHEMBL31183038CFHXBUHAAVSOHD-UHFFFAOYSA-NMFCD06809703SBB013761
Show more names
1-(2-Hydroxyethyl)-1h-benzimidazole-5-carboxylic acid - [H92762]1-(2-hydroxyethyl)-1H-benzimidazole-5-carboxylic acid(SALTDATA: FREE)
STK688584AKOS000365755ST4128509CS-0117067G73522F6070841-(2-hydroxyethyl)-1H-1,3-benzimidazole-5-carboxylic acid1H-Benzimidazole-5-carboxylic acid, 1-(2-hydroxyethyl)-
Database identifiers
- CAS
890094-09-4- PubChem CID
- 5200450
- DTXSID
DTXSID70409460
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 247
Physicochemical properties
- Boiling point
- 492.4 · 492.4±51.0 °C(Predicted)
- Density
- 1.43 · 1.43±0.1 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 2.89 · 2.89±0.30(Predicted)
- Appearance
- White to off-white Solid
- 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
Chemistry & industry
Suppliers6 total
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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