Morpholine, 4-((5-nitro-2-thienyl)carbonyl)-

HCID 207983

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Basic information

CAS: 31330-60-6
Standard SMILES: O=C(c1ccc([N+](=O)[O-])s1)N1CCOCC1
InChIKey: RKBSEAKDMUAGLJ-UHFFFAOYSA-N
Molecular formula: C9H10N2O4S
Average molar mass: 242.25 g/mol
Monoisotopic mass: 242.03612798

Names & identifiers

Preferred name: Morpholine, 4-((5-nitro-2-thienyl)carbonyl)-
IUPAC: morpholin-4-yl-(5-nitrothiophen-2-yl)methanone

Names & synonyms

Morpholine, 4-((5-nitro-2-thienyl)carbonyl)-5-Nitro-2-carboxythiophene-morpholinamide31330-60-6Morpholine, 4-(5-nitro-2-theonyl)-4-((5-Nitro-2-thienyl)carbonyl)morpholineDTXSID20185262RefChem:357590DTXCID30107753SCHEMBL13903414AKOS008929400AB00993427-01(Morpholin-4-yl)(5-nitrothiophen-2-yl)methanone

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Z31720948

Database identifiers

CAS: 31330-60-6
PubChem CID: 207983
DTXSID: DTXSID20185262

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 104 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 16
Formal charge: 0
Complexity: 288

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