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CAS No.: | 6714-29-0 |
---|---|
Name: | 2,3-dihydro-1H-imidazo[1,2-b]pyrazole |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C5H7 N3 |
Molecular Weight: | 109.131 |
Synonyms: | 2,3-Dihydro-1H-imidazo[1,2-b]pyrazole;IMPY; IMPY (antitumor agent); NSC 174124; NSC 51143;Pyrazolo[2,3-a]imidazolidine; Pyrazoloimidazole |
Density: | 1.439g/cm3 |
Melting Point: | 68.5°C |
Boiling Point: | 267.984°C at 760 mmHg |
Flash Point: | 115.873°C |
Safety: | Poison by intravenous route. Moderately toxic by intraperitoneal route. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx. |
PSA: | 29.85000 |
LogP: | 0.44660 |
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IUPAC: 3,5-Dihydro-2H-pyrazolo[1,5-a]imidazole
Imidazolepyrazole with CAS NO.of 6714-29-0 is also called for 2,3-Dihydro-1H-imidazo(1,2-b)pyrazole ; 1H-Pyrazolo(2,3-a)imidazole, 2,3-dihydro- ; 2,3-Dihydro-1H-imidazo(1,2-b)pyrazole ; AI3-63108 ; BA 21381 ; BRN 0742753 ; EINECS 229-769-2 ; IMPY ; NSC 174124 ; NSC 51143 ; NSC 641280 ; Pyrazolo(2,3-a)imidazolidine and so on.
CAS: 6714-29-0
Molecular Formula: C5H7N3
Molecular Weight: 109.12918
EINECS: 229-769-2
ACD/LogP: -0.92
ACD/LogD (pH 5.5): -2.92
ACD/LogD (pH 7.4): -2.92
ACD/BCF (pH 5.5): 1
ACD/BCF (pH 7.4): 1
ACD/KOC (pH 5.5): 1
ACD/KOC (pH 7.4): 1
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 0
Heavy Atom Count: 8
Formal Charge: 0
Complexity: 159
Isotope Atom Count: 0
Defined Atom StereoCenter Count: 0
Undefined Atom StereoCenter Count: 0
Defined Bond StereoCenter Count: 0
Undefined Bond StereoCenter Count: 0
Covalently-Bonded Unit Count: 1
Index of Refraction: 1.738
Molar Refractivity: 30.54 cm3
Molar Volume: 75.8 cm3
Surface Tension: 60.4 dyne/cm
Density: 1.43 g/cm3
Flash Point: 64.9°C
Enthalpy of Vaporization: 41.99 kJ/mol
Boiling Point: 183.7°C at 760 mmHg
Vapour Pressure: 0.761 mmHg at 25°C
The molecular structure of Imidazolepyrazole with CAS NO.of 6714-29-0:
Imidazolepyrazole (CAS NO.6714-29-0) is used as antineoplastic agent.
1. | dni-hmn:leu 3 mmol/L | CNREA8 Cancer Research. 43 (1983),5093. | ||
2. | dni-mus:fbr 300 µmol/L | BCPCA6 Biochemical Pharmacology. 20 (1971),2639. | ||
3. | ipr-mus LD50:410 mg/kg | NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program, Bethesda, MD 20205 JAN86 . | ||
4. | ivn-mus LD50:993 mg/kg | CTRRDO Cancer Treatment Reports. 64 (1980),1031. | ||
5. | ivn-dog LDLo:400 mg/kg | CTRRDO Cancer Treatment Reports. 64 (1980),1031. |
Poison by intravenous route. Moderately toxic by intraperitoneal route. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
Removal in wastewater treatment of Imidazolepyrazole (CAS NO.6714-29-0):
Total removal:1.86 percent
Total biodegradation:0.09 percent
Total sludge adsorption:1.76 percent
Total to air:0.00 percent
(using 10000 hr Bio P,A,S)