Basic information
- CAS
24269-44-1- Standard SMILES
CCN(CC)CCN1CCN(C(=O)OC)CC1.Cl- InChIKey
QQEZDFWLFFQWNP-UHFFFAOYSA-N- Molecular formula
- C12H26ClN3O2
- Average molar mass
- 279.81 g/mol
- Monoisotopic mass
- 279.1713548
Names & identifiers
- Preferred name
- 1-Piperazinecarboxylic acid, 4-(2-(diethylamino)ethyl)-, methyl ester, hydrochloride
- IUPAC
- methyl 4-[2-(diethylamino)ethyl]piperazine-1-carboxylate;hydrochloride
Names & synonyms
24269-44-11-Piperazinecarboxylic acid, 4-(2-(diethylamino)ethyl)-, methyl ester, hydrochloride4-(2-(Diethylamino)ethyl)-1-piperazinecarboxylic acid methyl ester hydrochlorideDTXSID30178968RefChem:233599DTXCID90101459Methyl 4-[2-(diethylamino)ethyl]piperazine-1-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
24269-44-1- PubChem CID
- 212380
- DTXSID
DTXSID30178968
Properties
Computed structural properties
- Topological polar surface area
- 36 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 224
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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