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2-(4-Chloro-3-nitrophenyl)-1H-imidazo(4,5-B)phenazine

HCID 3528599
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Basic information

CAS
303059-17-8
Standard SMILES
O=[N+]([O-])c1cc(-c2nc3cc4nc5ccccc5[nH]c4cc3n2)ccc1Cl
InChIKey
QCQQIVFXMYTOEO-UHFFFAOYSA-N
Molecular formula
C19H10ClN5O2
Average molar mass
375.8 g/mol
Monoisotopic mass
375.0523023

Names & identifiers

Preferred name
2-(4-Chloro-3-nitrophenyl)-1H-imidazo(4,5-B)phenazine
IUPAC
2-(4-chloro-3-nitrophenyl)-10H-imidazo[4,5-b]phenazine

Names & synonyms

303059-17-82-(4-chloro-3-nitrophenyl)-1H-imidazo[4,5-b]phenazine2-(4-CHLORO-3-NITROPHENYL)-1H-IMIDAZO(4,5-B)PHENAZINERefChem:457237658-729-0AKOS024423907

Database identifiers

CAS
303059-17-8
PubChem CID
3528599
EC Number
658-729-0

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
94.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
27
Formal charge
0
Complexity
838

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Related reactions

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Compound notes

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