4-AMINO-3-NITRO-2H-CHROMEN-2-ONE

Modify Date: 2025-09-30 19:18:38

4-AMINO-3-NITRO-2H-CHROMEN-2-ONE Structure
4-AMINO-3-NITRO-2H-CHROMEN-2-ONE structure
Common Name 4-AMINO-3-NITRO-2H-CHROMEN-2-ONE
CAS Number 38464-21-0 Molecular Weight 206.15500
Density 1.55g/cm3 Boiling Point 353.7ºC at 760 mmHg
Molecular Formula C9H6N2O4 Melting Point N/A
MSDS N/A Flash Point 167.7ºC

 Names

Name 4-amino-3-nitrochromen-2-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.55g/cm3
Boiling Point 353.7ºC at 760 mmHg
Molecular Formula C9H6N2O4
Molecular Weight 206.15500
Flash Point 167.7ºC
Exact Mass 206.03300
PSA 102.05000
LogP 2.38780
Index of Refraction 1.669
InChIKey FXAVOHDJSAUTTG-UHFFFAOYSA-N
SMILES Nc1c([N+](=O)[O-])c(=O)oc2ccccc12

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GN4931800
CHEMICAL NAME :
Coumarin, 4-amino-3-nitro-
CAS REGISTRY NUMBER :
38464-21-0
BEILSTEIN REFERENCE NO. :
1684486
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H6-N2-O4
MOLECULAR WEIGHT :
206.17
WISWESSER LINE NOTATION :
T66 BOVJ DNW EZ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 12,1590,1978

 Synthetic Route

~91%

4-AMINO-3-NITRO-2H-CHROMEN-2-ONE Structure

4-AMINO-3-NITRO...

CAS#:38464-21-0

Literature: Savel'ev, V. L.; Samsonova, O. L.; Troitskaya, V. S.; Vinokurov, V. G.; Lezina, V. P.; Smirnov, L. D. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1988 , p. 805 - 810 Khimiya Geterotsiklicheskikh Soedinenii, 1988 , vol. 24, # 7 p. 977 - 981

 Precursor & DownStream

Precursor  1

DownStream  1

 Synonyms

4-amino-3-nitro-2H-chromen-2-one
COUMARIN,4-AMINO-3-NITRO
3-nitro-4-aminocoumarin
4-Amino-3-nitrocoumarin
4-amino-3-nitro-chromen-2-one
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