Basic information
- CAS
631897-38-6- Standard SMILES
Cc1nc(I)c(C)[nH]1- InChIKey
GMGMFDAYRXIPQV-UHFFFAOYSA-N- Molecular formula
- C5H7IN2
- Average molar mass
- 222.03 g/mol
Names & identifiers
- Preferred name
- 5-iodo-2,4-dimethyl-1H-imidazole
- IUPAC
- 4-iodo-2,5-dimethyl-1H-imidazole
- English name
- 5-Iodo-2,4-dimethyl-1H-imidazole
- Molecular formula
- C5H7IN2
- Molecular weight
- 222.03
Names & synonyms
5-Iodo-2,4-dimethyl-1H-imidazole631897-38-6RefChem:536331848-012-24-iodo-2,5-dimethyl-1H-imidazoleImidazole, 5-iodo-2,4-dimethyl-SCHEMBL951803SCHEMBL980632SCHEMBL7322771MFCD279266725-Iodo-2,4-dimethyl-1H-imidazole #DB-124000
Show more names
1H-Imidazole, 5-iodo-2,4-dimethyl-
G26206EN300-7536133A1-08139
Database identifiers
- CAS
631897-38-6- PubChem CID
- 613638
- EC Number
- 848-012-2
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 86.5
Physicochemical properties
- Boiling point
- 358.7 · 358.7±22.0 °C(Predicted)
- Density
- 1.92 · 1.920±0.06 g/cm3(Predicted)
- pka
- 12.73 · 12.73±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H315-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers6 total
常州宣叶科技有限公司15195022192 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
常州优瑞医药科技有限公司18168818882 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Related reactions
8 records
Compound notes
Loading…