Ethyl 3-bromoimidazo[1,2-a]pyrimidine-2-carboxylate
Basic information
- CAS
134044-63-6- Standard SMILES
CCOC(=O)c1nc2ncccn2c1Br- InChIKey
HZSZIPSMUWWCFZ-UHFFFAOYSA-N- Molecular formula
- C9H8BrN3O2
- Average molar mass
- 270.08 g/mol
- Monoisotopic mass
- 268.97999
Names & identifiers
- Preferred name
- Ethyl 3-bromoimidazo[1,2-a]pyrimidine-2-carboxylate
- IUPAC
- ethyl 3-bromoimidazo[1,2-a]pyrimidine-2-carboxylate
- English name
- Ethyl 3-bromoimidazo[1,2-a]pyrimidine-2-carboxylate
- Molecular formula
- C9H8BrN3O2
- Molecular weight
- 270.08
Names & synonyms
ethyl 3-bromoimidazo[1,2-a]pyrimidine-2-carboxylate134044-63-6MFCD02186429C9H8BrN3O2DTXSID40391560AKOS0050702623-bromo-imidazo[1,2-a]pyrimidine-2-carboxylic acid ethyl esterCS-00943553R-0684FT-0680302Z4101A887971
Show more names
Imidazo[1,2-a]pyrimidine-2-carboxylic acid, 3-bromo-, ethyl esterETHYL 3-BROMOIMIDAZO[1,2-A]PYRIMIDINE-2-CARBOXYLATE ISO 9001：2015 REACH
SCHEMBL31415413SBB054082SY104219F067126J-520859ethyl 3-bromo-4-hydroimidazo[1,2-a]pyrimidine-2-carboxylate
Database identifiers
- CAS
134044-63-6- PubChem CID
- 3334249
- DTXSID
DTXSID40391560- Nikkaji
- J374.511B
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 252
Physicochemical properties
- Melting point
- 201 · 201-203°
- Density
- 1.72 · 1.72±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- -0.97 · -0.97±0.30(Predicted)
- form
- solid
- color
- White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HazardClass
- IRRITANT
- HS Code
- 2933599590 · 2933599590
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
- hs_code
- 2933599590
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…