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2-methoxy-7-nitroacridin-9(10H)-one

HCID 2848907
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
13244-38-7
Standard SMILES
COc1ccc2[nH]c3ccc([N+](=O)[O-])cc3c(=O)c2c1
InChIKey
GHDTZAUUYUVUKM-UHFFFAOYSA-N
Molecular formula
C14H10N2O4
Average molar mass
270.24 g/mol
Monoisotopic mass
270.0640568

Names & identifiers

Preferred name
2-methoxy-7-nitroacridin-9(10H)-one
IUPAC
2-methoxy-7-nitro-10H-acridin-9-one

Names & synonyms

2-methoxy-7-nitroacridin-9(10H)-one2-Methoxy-7-nitro-10H-acridin-9-one13244-38-72-methoxy-7-nitro-9,10-dihydroacridin-9-oneCHEMBL20424665486-12-4CBMicro_029521Cambridge id 5486124DTXSID10385931BDBM50385967EBC-06824STK387413
Show more names
AKOS0006783092-methoxy-7-nitro-9(10H)-acridinone2-methoxy-7-nitro-10-hydroacridin-9-oneBIM-0029454.P001EU-0067021ST503310105,9-Dimethoxy-8-nitrophenanthridin-6(5H)-oneEN300-26867827

Database identifiers

CAS
13244-38-7、5486-12-4
PubChem CID
2848907
DTXSID
DTXSID10385931
ChEMBL
CHEMBL2042466
Nikkaji
J2.362.182G

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
84.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
20
Formal charge
0
Complexity
408

Related reactions

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Compound notes

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