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4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 3,3-dimethyl-7-oxo-6-[[2-(2-propenylthio)acetyl]amino]-, (2S,5R,6R)- (87-09-2)

Identification
Name:4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 3,3-dimethyl-7-oxo-6-[[2-(2-propenylthio)acetyl]amino]-, (2S,5R,6R)-
Synonyms:4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 3,3-dimethyl-7-oxo-6-[[(2-propenylthio)acetyl]amino]-, (2S,5R,6R)- (9CI);4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,3,3-dimethyl-7-oxo-6-[[(2-propenylthio)acetyl]amino]-, [2S-(2a,5a,6b)]-; 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,6-[2-(allylthio)acetamido]-3,3-dimethyl-7-oxo- (7CI,8CI); Penicillin O (6CI);Allomercaptomethylpenicillin; Allylmercaptomethylpenicillin;Allylmercaptomethylpenicillinic acid; Allylthiomethylpenicillin; Almecillin;Cer-O-Cillin; Penicillin AT; Penicillin, [(2-propenylthio)methyl]-
CAS:87-09-2
Molecular Formula: C13H18 N2 O4 S2
Molecular Weight: 330.45
InChI: InChI=1/C13H18N2O4S2/c1-4-5-20-6-7(16)14-8-10(17)15-9(12(18)19)13(2,3)21-11(8)15/h4,8-9,11H,1,5-6H2,2-3H3,(H,14,16)(H,18,19)/t8-,9+,11-/m1/s1
Molecular Structure: (C13H18N2O4S2) 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 3,3-dimethyl-7-oxo-6-[[(2-propenylthio)acetyl]am...
Properties
Flash Point: 334.7°C
Boiling Point: 629.8°C at 760 mmHg
Density:1.41g/cm3
Refractive index:1.631
Specification:

Allylmercaptomethylpenicillin (CAS NO.87-09-2) is also called as Almecillin [INN] ; Penicillin O ; (2S,5R,6R)-6-(2-(Allylthio)acetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptan-2-carbonsaeure ; 4-27-00-05887 (Beilstein Handbook Reference) ; 6-(2-(Allylthio)acetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid ; Allylmercaptomethylpenicillinic acid ; Allylthiomethylpenicillin ; Almecilina ; Almecilina [INN-Spanish] ; Almecillin ; Almecillina ; Almecillina [DCIT] ; Almecilline ; Almecilline [INN-French] ; Almecillinum ; Almecillinum [INN-Latin] ; Almezillin ; BRN 0044307 ; Cer-O-Cillin ; Penicillin AT ; Penicillin O ; UNII6246WH0S1O ; 3,3-Dimethyl-7-oxo-6-(((2-propenylthio)acetyl)amino)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid ; 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-(((2-propenylthio)acetyl)amino)- .

Flash Point: 334.7°C
Safety Data
 

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