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N-(2-(2-(13-Henicosen-1-yl)-4,5-dihydro-1H-imidazol-1-yl)ethyl)ethylenediamine

HCID 6366368
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Basic information

CAS
94022-17-0
Standard SMILES
CCCCCCC/C=C/CCCCCCCCCCCCC1=NCCN1CCNCCN
InChIKey
FHSANRAQFHKSOJ-CMDGGOBGSA-N
Molecular formula
C28H56N4
Average molar mass
448.8 g/mol
Monoisotopic mass
448.4504978

Names & identifiers

Preferred name
N-(2-(2-(13-Henicosen-1-yl)-4,5-dihydro-1H-imidazol-1-yl)ethyl)ethylenediamine
IUPAC
N'-[2-[2-[(E)-henicos-13-enyl]-4,5-dihydroimidazol-1-yl]ethyl]ethane-1,2-diamine

Names & synonyms

EINECS 301-511-494022-17-0N-(2-(2-(13-Henicosen-1-yl)-4,5-dihydro-1H-imidazol-1-yl)ethyl)ethylenediamineFHSANRAQFHKSOJ-CMDGGOBGSA-N

Database identifiers

CAS
94022-17-0
PubChem CID
6366368
EC Number
301-511-4
Nikkaji
J367.956J

Properties

Computed structural properties

XLogP
7.7
Topological polar surface area
53.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
24
Heavy atoms
32
Formal charge
0
Complexity
447

Related reactions

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Compound notes

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