Basic information
- CAS
6237-24-7- Standard SMILES
CN(C)CCCNc1c2ccccc2nc2cc([N+](=O)[O-])ccc12- InChIKey
BOBCFIQLKNNHRJ-UHFFFAOYSA-N- Molecular formula
- C18H20N4O2
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.15862589
Names & identifiers
- Preferred name
- 3-Nitro-9-(dimethylaminopropylamino)acridine
- IUPAC
- N',N'-dimethyl-N-(3-nitroacridin-9-yl)propane-1,3-diamine
- English name
- 3-Nitro-9-[3-(dimethylamino)propylamino]acridine
- Molecular formula
- C18H20N4O2
- Molecular weight
- 324.38
Names & synonyms
3-Nitro-9-(dimethylaminopropylamino)acridine6237-24-7C-257RM9GPV4GNTACRIDINE, 9-((3-(DIMETHYLAMINO)PROPYL)AMINO)-3-NITRO-1,3-Propanediamine, N,N-dimethyl-N'-(3-nitro-9-acridinyl)-CCRIS 1976BRN 04968503-Nitro-9-(3'-dimethylaminopropylamino)acridine143715-88-2UNII-RM9GPV4GNTC 257
Show more names
3-Nitro-9-[3-(dimethylamino)propylamino]acridineN-[3-(Dimethylamino)propyl]-3-nitroacridin-9-amine
DTXSID70211424N,N-Dimethyl-N'-(3-nitro-acridin-9-yl)-propane-1,3-diamine1,3-PROPANEDIAMINE, N1,N1-DIMETHYL-N3-(3-NITRO-9-ACRIDINYL)-N~1~,N~1~-Dimethyl-N~3~-(3-nitroacridin-9-yl)propane-1,3-diamineN1,N1-DIMETHYL-N3-(3-NITRO-9-ACRIDINYL)-1,3-PROPANEDIAMINE
Database identifiers
- CAS
6237-24-7- PubChem CID
- 22604
- DTXSID
DTXSID70211424- UNII
- RM9GPV4GNT
- Nikkaji
- J66.917B
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 74 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 426
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Boiling point
- 462.71 °C · 462.71°C (rough estimate)
- Density
- 1.2155 · 1.2155 (rough estimate)
- refractive index
- 1.67 · 1.6700 (estimate)
- FDA UNII
- 9 GPV4GNT · RM9GPV4GNT
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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