Morpholine, 4-(2-(2-nitro-1H-imidazol-1-yl)ethyl)-

HCID 100573
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Basic information

CAS
36664-18-3
Standard SMILES
O=[N+]([O-])c1nccn1CCN1CCOCC1
InChIKey
NAEIQHMISIYBGX-UHFFFAOYSA-N
Molecular formula
C9H14N4O3
Average molar mass
226.23 g/mol
Monoisotopic mass
226.10659031

Names & identifiers

Preferred name
Morpholine, 4-(2-(2-nitro-1H-imidazol-1-yl)ethyl)-
IUPAC
4-[2-(2-nitroimidazol-1-yl)ethyl]morpholine

Names & synonyms

36664-18-3Morpholine, 4-(2-(2-nitro-1H-imidazol-1-yl)ethyl)-4-(2-(2-Nitro-1H-imidazol-1-yl)ethyl)morpholine4-[2-(2-nitro-1H-imidazol-1-yl)ethyl]morpholineSCHEMBL366282DTXSID60190118NAEIQHMISIYBGX-UHFFFAOYSA-NNSC321263NSC 321263NSC-321263

Database identifiers

CAS
36664-18-3
PubChem CID
100573
DTXSID
DTXSID60190118
Nikkaji
J1.584.643G

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
76.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
16

Experimental & physicochemical properties

LogP-0.1

Related reactions

6 records
New reaction record

Compound notes

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