Domine

HCID 14932

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Basic information

CAS: 1339-72-6
Standard SMILES: CCCCCCCCCCCCN(C)CCN(C)C
InChIKey: LLJOASAHEBQANS-UHFFFAOYSA-N
Molecular formula: C17H38N2
Average molar mass: 270.5 g/mol
Monoisotopic mass: 270.30349922

Names & identifiers

Preferred name: Domine
IUPAC: N'-dodecyl-N,N,N'-trimethylethane-1,2-diamine

Names & synonyms

DOMINEPruraineUNII-5KT73O4RKV5KT73O4RKVN-Dodecyl-N,N,N'-trimethylethylenediamine94823-32-2N-Dodecyl-N,N',N'-trimethyl-ethane-1,2-diamine1339-72-6SCHEMBL10380687DTXSID10915292N'-dodecyl-N,N,N'-trimethyl-ethane-1,2-diamineQ27262493

Show more names

1,2-ETHANEDIAMINE, N1-DODECYL-N1,N2,N2-TRIMETHYL-N~1~-dodecyl-N~1~,N~2~,N~2~-trimethyl-1,2-ethanediamineN~1~-Dodecyl-N~1~,N~2~,N~2~-trimethylethane-1,2-diamine

Database identifiers

CAS: 1339-72-6、94823-32-2
PubChem CID: 14932
DTXSID: DTXSID10915292
UNII: 5KT73O4RKV
Nikkaji: J1.844.792D

Properties

Computed structural properties

XLogP: 5.9
Topological polar surface area: 6.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 14
Heavy atoms: 19
Formal charge: 0
Complexity: 169

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