ethyl 4-amino-2-methyl-1H-imidazole-5-carboxylate
Basic information
- CAS
32704-58-8- Standard SMILES
CCOC(=O)c1[nH]c(C)nc1N- InChIKey
VVSXLQGOMPVZPR-UHFFFAOYSA-N- Molecular formula
- C7H11N3O2
- Average molar mass
- 169.18 g/mol
- Monoisotopic mass
- 169.0851266
Names & identifiers
- Preferred name
- ethyl 4-amino-2-methyl-1H-imidazole-5-carboxylate
- IUPAC
- ethyl 4-amino-2-methyl-1H-imidazole-5-carboxylate
- English name
- 5-Amino-2-methyl-3H-imidazole-4-carboxylic acid ethyl ester
- Molecular formula
- C7H11N3O2
- Molecular weight
- 169.18
Names & synonyms
ethyl 4-amino-2-methyl-1H-imidazole-5-carboxylate32704-58-8DTXSID60336736RefChem:343825DTXCID502878245-Amino-2-methyl-3H-imidazole-4-carboxylic acid ethyl esterEthyl 5-amino-2-methyl-1H-imidazole-4-carboxylateOprea1_510193SCHEMBL8292169VVSXLQGOMPVZPR-UHFFFAOYSA-NHBA70458AKOS011075018
Show more names
1H-Imidazole-4-carboxylic acid, 5-amino-2-methyl-, ethyl ester
AKOS022480707SB36611DB-297551CS-0262185EN300-81689G57879ethyl4-amino-2-methyl-1H-imidazole-5-carboxylateEthyl 5-amino-2-methyl-1H-imidazole-4-carboxylate #
Database identifiers
- CAS
32704-58-8- PubChem CID
- 535899
- DTXSID
DTXSID60336736- Nikkaji
- J2.363.885A
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 81 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- 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
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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