Basic information
- CAS
24370-25-0- Standard SMILES
NC(=O)Nc1nc2ccccc2[nH]1- InChIKey
LNYZEFQMIURYEI-UHFFFAOYSA-N- Molecular formula
- C8H8N4O
- Average molar mass
- 176.18 g/mol
- Monoisotopic mass
- 176.06981089
Overview
2-benzimidazolylurea is a beige solid. (NTP, 1992)
Names & identifiers
- Preferred name
- N-1H-Benzimidazol-2-ylurea
- IUPAC
- 1H-benzimidazol-2-ylurea
- English name
- 2-Benzimidazolylurea
- Molecular formula
- C8H8N4O
- Molecular weight
- 176.18
Names & synonyms
2-Benzimidazolylurea24370-25-0Benzimidazol-2-ylurea2-Benzimidazoleurea2-UreidobenzimidazoleUrea, 1H-benzimidazol-2-yl-Urea, (2-benzimidazolyl)-DTXSID3024574Y7B0YQ5TBDNSC-84166DTXCID104574RefChem:465535
Show more names
(2-benzimidazolyl)-ureEmedastine Impurity 152-Benzimidazolylurea,97%
2-BZIUN-1H-benzimidazol-2-ylurea246-209-21H-Benzimidazol-2-ylureaCCRIS 5968EINECS 246-209-2UNII-Y7B0YQ5TBDNSC 84166
Database identifiers
- CAS
24370-25-0- PubChem CID
- 32346
- DTXSID
DTXSID3024574- ChEMBL
CHEMBL1576153- UNII
- Y7B0YQ5TBD
- EC Number
- 246-209-2
- Nikkaji
- J49.070I
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 208
Experimental & physicochemical properties
Solubilityless than 1 mg/mL at 73 °F (NTP, 1992)
Melting Pointgreater than 572 °F (NTP, 1992)
Physical Description2-benzimidazolylurea is a beige solid. (NTP, 1992)
Physicochemical properties
- Melting point
- 300 °C · >300 °C(lit.)
- Density
- 1.527 · 1.527±0.06 g/cm3(Predicted)
- pka
- 11.01 · 11.01±0.10(Predicted)
- form
- powder
- InChI
- 1S/C8H8N4O/c9-7(13)12-8-10-5-3-1-2-4-6(5)11-8/h1-4H,(H4,9,10,11,12,13)
- InChIKey
- LNYZEFQMIURYEI-UHFFFAOYSA-N
- SMILES
- NC(=O)Nc1nc2ccccc2[nH]1
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 7 B0YQ5TBD · Y7B0YQ5TBD
- EPA Substance Registry System
- 2 · 2-Benzimidazolylurea (24370-25-0)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Health HazardsACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes. (NTP, 1992)
Reactive GroupAmides and Imides
Reactivity Profile
Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides.
Air and Water ReactionsInsoluble in water.
Safety & protection
Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill Response
Chemistry & industry
Applications
General DescriptionBeige solid.
Suppliers9 total
西安美科生物科技有限公司029-18710438009 18710438009 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
石家庄瑞田生化有限公司15831127780 · [email protected]
湖北扬信医药科技有限公司07143299675 13092790750 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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