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CAS No.: | 99814-12-7 |
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Name: | SIPPR 113 |
Molecular Structure: | |
Formula: | C30H38 O8 |
Molecular Weight: | 526.68 |
Synonyms: | A-Norpregn-20-yne-2,17-diol,2-ethynyl-, bis(hydrogen butanedioate), (2b,5a,17a)-; AF 113; Butanedioic acid,1,7-diethynylhexadecahydro-8a,10a-dimethyldicyclopenta[a,f]naphthalene-1,7-diylester, [1R-(1a,3ab,3ba,5ab,7a,8aa,8bb,10aa)]-; SIPPR 113 |
Density: | 1.27g/cm3 |
Boiling Point: | 653.3°Cat760mmHg |
Flash Point: | 208°C |
Safety: | Experimental reproductive effects. When heated to decomposition it emits acrid smoke and irritating fumes. |
PSA: | 127.20000 |
LogP: | 4.19900 |
IUPAC Name: 4-[[(1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diethynyl-1-(4-hydroxy-4-oxobutanoyl)oxy-8a,10a-dimethyl-2,3,3a,3b,4,5,5a,6,8,8b,9,10-dodecahydroindeno[5,4-e]inden-7-yl]oxy]-4-oxobutanoic acid
Molecular Formula: C30H38O8
Molecular Weight: 526.68
Freely Rotating Bonds: 10
Polar Surface Area: 105.2 Å2
Index of Refraction: 1.571
Molar Refractivity: 135.36 cm3
Molar Volume: 411.7 cm3
Polarizability: 53.66 ×10-24 cm3
Surface Tension: 59.8 dyne/cm
Density: 1.27 g/cm3
Flash Point: 208 °C
Enthalpy of Vaporization: 104.97 kJ/mol
Boiling Point: 653.3 °C at 760 mmHg
Vapour Pressure: 9.38E-19 mmHg at 25°C
The Cas Register Number of Sippr-113 is 99814-12-7.The chemical synonyms of Sippr-113 (CAS NO.99814-12-7) are 2-Alpha,17-alpha-diethynyl-A-nor-5-alpha-androstane-2-beta,17-beta-diol dihemisuccinate ; A-Nor-5-alpha,17-alpha-pregn-20-yne-2-beta,17-diol, 2-ethynyl-, dihemisuccinate ; A-Norpregn-20-yne-2,17-diol, 2-ethynyl-, bis(hydrogen butanedioate), (2beta,5alpha,17alpha)- .The molecular structure of Sippr-113 (CAS NO.99814-12-7) is.
Sippr-113 (CAS NO.99814-12-7) is used as organic intermediate.
1. | orl-rat TDLo:1 mg/kg (1D preg):REP | CCPTAY Contraception. 32 (1985),301. |
Experimental reproductive effects. When heated to decomposition it emits acrid smoke and irritating fumes.
WGK Germany: 2
RTECS: VV2000000
F: 10-21
HazardClass: 6.1
PackingGroup: III