Basic information
- CAS
63589-26-4- Standard SMILES
COCCCNC(=O)c1cc(N)c2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O- InChIKey
LXOWAMNDRCJQED-UHFFFAOYSA-N- Molecular formula
- C19H17N3O6
- Average molar mass
- 383.4 g/mol
- Monoisotopic mass
- 383.11173527
Names & identifiers
- Preferred name
- 2-Anthracenecarboxamide, 4-amino-9,10-dihydro-N-(3-methoxypropyl)-1-nitro-9,10-dioxo-
- IUPAC
- 4-amino-N-(3-methoxypropyl)-1-nitro-9,10-dioxoanthracene-2-carboxamide
- English name
- 4-amino-9,10-dihydro-N-(3-methoxypropyl)-1-nitro-9,10-dioxoanthracene-2-carboxamide
- Molecular formula
- C19H17N3O6
- Molecular weight
- 383.35
Names & synonyms
63589-26-4EINECS 264-348-7EA41GJM9G3UNII-EA41GJM9G32-Anthracenecarboxamide, 4-amino-9,10-dihydro-N-(3-methoxypropyl)-1-nitro-9,10-dioxo-DTXSID10699504-Amino-9,10-dihydro-N-(3-methoxypropyl)-1-nitro-9,10-dioxo-2-anthracenecarboxamideRefChem:85426DTXCID3043994264-348-74-Amino-9,10-dihydro-N-(3-methoxypropyl)-1-nitro-9,10-dioxoanthracene-2-carboxamideLXOWAMNDRCJQED-UHFFFAOYSA-N
Show more names
4-AMINO-N-(3-METHOXYPROPYL)-1-NITRO-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-CARBOXAMIDEDB-295185NS00035498
Database identifiers
- CAS
63589-26-4- PubChem CID
- 5485986
- DTXSID
DTXSID1069950- UNII
- EA41GJM9G3
- EC Number
- 264-348-7
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 648
Physicochemical properties
- FDA UNII
- 41 GJM9G3 · EA41GJM9G3
- EPA Substance Registry System
- 2 · 2-Anthracenecarboxamide, 4-amino-9,10-dihydro-N-(3-methoxypropyl)-1-nitro-9,10-dioxo- (63589-26-4)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Anthracenecarboxamide, 4-amino-9,10-dihydro-N-(3-methoxypropyl)-1-nitro-9,10-dioxo-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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