Piperazine, 1-(5,6,7,8-tetrahydro-1-naphthalenyl)-, (Z)-2-butenedioate (1:1)
Basic information
- CAS
57537-09-4- Standard SMILES
O=C(O)/C=C/C(=O)O.c1cc2c(c(N3CCNCC3)c1)CCCC2- InChIKey
FCHNSQBYMSXEOD-WLHGVMLRSA-N- Molecular formula
- C18H24N2O4
- Average molar mass
- 332.4 g/mol
- Monoisotopic mass
- 332.17360725
Names & identifiers
- Preferred name
- Piperazine, 1-(5,6,7,8-tetrahydro-1-naphthalenyl)-, (Z)-2-butenedioate (1:1)
- IUPAC
- (E)-but-2-enedioic acid;1-(5,6,7,8-tetrahydronaphthalen-1-yl)piperazine
Names & synonyms
Piperazine, 1-(5,6,7,8-tetrahydro-1-naphthalenyl)-, (Z)-2-butenedioate (1:1)57537-09-4RefChem:10958891-(5-Tetralyl)piperazine maleate1-(5,6,7,8-Tetrahydro-1-naphthalenyl)piperazine (Z)-2-butenedioate
Database identifiers
- CAS
57537-09-4- PubChem CID
- 6446352
Properties
Computed structural properties
- Topological polar surface area
- 89.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 342
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