Basic information
- CAS
1439902-57-4- Standard SMILES
O=C(O)c1cn(CC2CC2)cn1- InChIKey
OAWDVBMYXJMTLN-UHFFFAOYSA-N- Molecular formula
- C8H10N2O2
- Average molar mass
- 166.18 g/mol
- Monoisotopic mass
- 166.07422757
Names & identifiers
- Preferred name
- 1-(Cyclopropylmethyl)-1H-imidazole-4-carboxylic acid
- IUPAC
- 1-(cyclopropylmethyl)imidazole-4-carboxylic acid
- English name
- 1-(Cyclopropylmethyl)-1H-imidazole-4-carboxylic acid
- Molecular formula
- C8H10N2O2
- Molecular weight
- 166.18
Names & synonyms
1-(Cyclopropylmethyl)-1H-imidazole-4-carboxylic acid1439902-57-41-(cyclopropylmethyl)imidazole-4-carboxylic acidMFCD260970031-(Cyclopropylmethyl)-1H-imidazole-4-carboxylicacidSCHEMBL4735501DTXSID801208889AKOS026706933KS-8114CS-0446595F0967731H-Imidazole-4-carboxylic acid, 1-(cyclopropylmethyl)-
Show more names
F1907-1350
Database identifiers
- CAS
1439902-57-4- PubChem CID
- 69167238
- DTXSID
DTXSID801208889
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 191
Chemistry & industry
Suppliers3 total
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…