7-Methoxy-3-nitroquinoline

HCID 609280
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
39977-95-2
Standard SMILES
COc1ccc2cc([N+](=O)[O-])cnc2c1
InChIKey
HVGPUJMRYVXJMW-UHFFFAOYSA-N
Molecular formula
C10H8N2O3
Average molar mass
204.18 g/mol
Monoisotopic mass
204.05349212

Names & identifiers

Preferred name
7-Methoxy-3-nitroquinoline
IUPAC
7-methoxy-3-nitroquinoline
English name
7-METHOXY-3-NITROQUINOLINE
Molecular formula
C10H8N2O3
Molecular weight
204.18

Names & synonyms

7-Methoxy-3-nitroquinoline39977-95-2DTXSID10346062RefChem:310972DTXCID00297135HVGPUJMRYVXJMW-UHFFFAOYSA-N7-methoxy-3-nitro-quinoline7-methoxy-3-nitroquino-lineSCHEMBL2812139STL186122AKOS001591697CS-0367472
Show more names
Quinoline, 7-methoxy-3-nitro-2-(2-nitrophenyl)-3-oxobutanenitrile
EU-0000349ST50814344

Database identifiers

CAS
39977-95-2
PubChem CID
609280
DTXSID
DTXSID10346062
Nikkaji
J1.397.634A

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
67.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
15

Physicochemical properties

Boiling point
356.59 · 356.590±22.00 °C(Press: 760.00 Torr)(predicted)
Density
1.338 · 1.338±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
0.833 · 0.833±0.10(predicted)

Chemistry & industry

Suppliers1 total

四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

Loading…