4-Aminoantipyrine N-Carbamic Acid Methyl Ester

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Names

[ CAS No. ]:
10077-96-0

[ Name ]:
4-Aminoantipyrine N-Carbamic Acid Methyl Ester

[Synonym ]:
2,3-Dimethyl-5-oxo-3-pyrazoline-4-carbamic acid methyl ester
2,3-dimethyl-5-oxo-1-phenyl-3-pyrazoline-4-carbamic acid methyl ester
F0300-0167
3-Pyrazoline-4-carbamic acid,2,3-dimethyl-5-oxo-,methyl ester
4-Aminoantipyrine N-Carbamic Acid Methyl Ester
4-Methoxycarbonylamino-2,3-dimethyl-1-phenyl-pyrazol-5-on
4-Carbomethoxyamino-2,3-dimethyl-1-phenylpyrazol-5-one

Chemical & Physical Properties

[ Density]:
1.3g/cm3

[ Molecular Formula ]:
C13H15N3O3

[ Molecular Weight ]:
261.27600

[ Exact Mass ]:
261.11100

[ PSA ]:
68.75000

[ LogP ]:
1.67630

[ Index of Refraction ]:
1.615

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UQ8955000
CHEMICAL NAME :
3-Pyrazoline-4-carbamic acid, 2,3-dimethyl-5-oxo-, methyl ester
CAS REGISTRY NUMBER :
10077-96-0
BEILSTEIN REFERENCE NO. :
0276625
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H15-N3-O3
MOLECULAR WEIGHT :
261.31
WISWESSER LINE NOTATION :
T5NNVJ A1 BR& DMVO1 E1

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 :
58 mg/kg
TOXIC EFFECTS :
Nutritional and Gross Metabolic - body temperature decrease Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation
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: 15,396,1981

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4-Aminoantipyrine
  • Dimethyl Carbonate
  • Methyl chloroformate
  • (1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-carbothioamidoic acid O-methyl ester

DownStream

  • methyl N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N-methylcarbamate

Related Compounds

  • (R)-(+)-4-(N-carbomethoxy-N-methyl)-2,2-diphenylvaleronitrile
  • (4-methyl-cyclohexyl)-carbamic acid methyl ester
  • (4-methoxy-styryl)-carbamic acid methyl ester
  • (4-methyl-cyclohexyl)-carbamic acid methyl ester
  • (4-nitro-styryl)-carbamic acid methyl ester
  • (4-chloro-phenoxysulfonyl)-carbamic acid methyl ester
  • 4-(Bromomethyl)-3-(methoxymethyl)benzoic acid
  • 6-(4-Aminophenoxy)-5-(4-phenoxyphenyl)pyrimidin-4-amine
  • 1-(4-(((6-amino-5-(1-benzyl-1H-pyrazol-4-yl)pyrimidin-4-yl)amino)methyl)piperidin-1-yl)prop-2-en-1-one
  • US9580449, Example A27
  • 1-(4-(((6-Amino-5-(4-phenoxyphenyl)pyrimidin-4-yl)amino)methyl)-4-hydroxypiperidin-1-yl)prop-2-en-1-one
  • (4-(((6-Amino-5-(4-phenoxyphenyl)pyrimidin-4-yl)amino)methyl)piperidin-1-yl)(cyclobut-1-en-1-yl)methanone
  • N4-[(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)methyl]-N2,N2,N4-trimethylpyrimidine-2,4-diamine
  • (9H-fluoren-9-yl)methyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate
  • 4-Cyclobutyltetrahydro-2H-pyran-4-OL
  • 1-[4-[[(6-Amino-2'-phenoxy[5,5'-bipyrimidin]-4-yl)amino]methyl]-1-piperidinyl]-2-propen-1-one
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