Basic information
- Standard SMILES
Cl.O=C(O)C1CN=CNC1- InChIKey
TXTRXEIKYAFUIX-UHFFFAOYSA-N- Molecular formula
- C5H9ClN2O2
- Average molar mass
- 164.59 g/mol
- Monoisotopic mass
- 164.0352552
Names & identifiers
- Preferred name
- 1,4,5,6-Tetrahydropyrimidine-5-carboxylic acid hydrochloride
- IUPAC
- 1,4,5,6-tetrahydropyrimidine-5-carboxylic acid;hydrochloride
Names & synonyms
1,4,5,6-Tetrahydropyrimidine-5-carboxylic acid hydrochloride146436-66-0SCHEMBL8306668TXTRXEIKYAFUIX-UHFFFAOYSA-NWFA43666EBC-181963EN300-255764Z23278836971,4,5,6-Tetrahydropyrimidine-5-carboxylicacidhydrochloride1,4,5,6-tetrahydropyrimidine-5-carboxylic acid;hydrochloride
Database identifiers
- PubChem CID
- 70342184
Properties
Computed structural properties
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 144
Related reactions
13 records
Linked notes
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