4-Acetylpiperazine-1-carboxylic acid
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Basic information
- CAS
148490-38-4- Standard SMILES
CC(=O)N1CCN(C(=O)O)CC1- InChIKey
DDOWCQQXWQWZQD-UHFFFAOYSA-N- Molecular formula
- C7H12N2O3
- Average molar mass
- 172.18 g/mol
- Monoisotopic mass
- 172.08479225
Names & identifiers
- Preferred name
- 4-Acetylpiperazine-1-carboxylic acid
- IUPAC
- 4-acetylpiperazine-1-carboxylic acid
- English name
- 1-Piperazinecarboxylicacid,4-acetyl-(9CI)
- Molecular formula
- C7H12N2O3
- Molecular weight
- 172.18
Names & synonyms
148490-38-44-ACETYLPIPERAZINE-1-CARBOXYLIC ACID1-Piperazinecarboxylicacid,4-acetyl-(9CI)SCHEMBL429339SCHEMBL2991648SCHEMBL10401946DTXSID806003251-Piperazinecarboxylic acid, 4-acetyl-DB-280121
Database identifiers
- CAS
148490-38-4- PubChem CID
- 19821614
- DTXSID
DTXSID80600325
Properties
Computed structural propertiesFilling in
- XLogP
- -0.9
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 197
Related reactions
0 records
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Compound notes
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