3,5-DINITROPHENOL

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Names

[ CAS No. ]:
586-11-8

[ Name ]:
3,5-DINITROPHENOL

[Synonym ]:
3,5-DINITROPHENOL
Phenol,3,5-dinitro
3,5-Dinitrofenol
3,5-dinitro-phenol
3.5-Dinitro-1-hydroxy-benzol

Chemical & Physical Properties

[ Density]:
1.65g/cm3

[ Boiling Point ]:
341.1ºC at 760mmHg

[ Molecular Formula ]:
C6H4N2O5

[ Molecular Weight ]:
184.10600

[ Flash Point ]:
157.2ºC

[ Exact Mass ]:
184.01200

[ PSA ]:
111.87000

[ LogP ]:
2.25500

[ Index of Refraction ]:
1.649

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SL3050000
CHEMICAL NAME :
Phenol, 3,5-dinitro-
CAS REGISTRY NUMBER :
586-11-8
BEILSTEIN REFERENCE NO. :
1879348
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C6-H4-N2-O5
MOLECULAR WEIGHT :
184.12
WISWESSER LINE NOTATION :
WNR CQ ENW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
45 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPPMAB Journal of Pharmacy and Pharmacology. (Pharmaceutical Soc. of Great Britain, 1 Lambeth High St., London SEI 7JN, UK) V.1- 1949- Volume(issue)/page/year: 11,462,1959
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
50 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPPMAB Journal of Pharmacy and Pharmacology. (Pharmaceutical Soc. of Great Britain, 1 Lambeth High St., London SEI 7JN, UK) V.1- 1949- Volume(issue)/page/year: 11,462,1959
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPPMAB Journal of Pharmacy and Pharmacology. (Pharmaceutical Soc. of Great Britain, 1 Lambeth High St., London SEI 7JN, UK) V.1- 1949- Volume(issue)/page/year: 11,462,1959

Safety Information

[ RIDADR ]:
UN 1320

[ Packaging Group ]:
I

[ Hazard Class ]:
4.1

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 3,5-Dinitroanisole
  • 4-amino-3,5-dinitro-phenol
  • Acetaldoxime
  • 1,3,5-trinitrobenzene
  • 5-acetoxy-2-acetylamino-1,3-dinitrobenzene
  • Phenol
  • (4-benzamidophenyl) benzoate
  • 2,4-Dinitrophenylacetat

DownStream

  • 2-Bromo-5-nitrophenol
  • 5-Amino-2-bromophenol
  • 3-Amino-5-nitrophenol

Related Compounds

  • 4-amino-3,5-dinitrophenol
  • 2-amino-3,5-dinitrophenol
  • 4-methyl-3,5-dinitrophenol
  • 4-fluoro-3,5-dinitrophenol
  • 2-methyl-3,5-dinitrophenol
  • 2-methoxy-3,5-dinitrophenol
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • N-(4-acetylphenyl)-2-(7-oxo-8-((p-tolylamino)methyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-6(7H)-yl)acetamide
  • Phosphorothioic acid, O-((4-chlorophenyl)cyanomethyl) O,O-diethyl ester
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • 1-[(5-Bromopentyl)oxy]-2,4-dichlorobenzene
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde