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4H-1-Benzopyran-4-one,6(or 8)-[[bis(2-chloroethyl)amino]methyl]-3-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-(9CI) (85625-48-5)

Identification
Name:4H-1-Benzopyran-4-one,6(or 8)-[[bis(2-chloroethyl)amino]methyl]-3-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-(9CI)
Synonyms:Rutin-N-mustard
CAS:85625-48-5
Molecular Formula: C32H39 Cl2 N O16
Molecular Weight: 0
InChI: InChI=1/C32H39Cl2NO16/c1-12-21(39)25(43)27(45)31(48-12)47-11-19-23(41)26(44)28(46)32(50-19)51-30-24(42)20-18(49-29(30)13-2-3-15(36)17(38)8-13)9-16(37)14(22(20)40)10-35(6-4-33)7-5-34/h2-3,8-9,12,19,21,23,25-28,31-32,36-41,43-46H,4-7,10-11H2,1H3/t12-,19+,21-,23+,25+,26-,27+,28+,31+,32-/m0/s1
Molecular Structure: (C32H39Cl2NO16) Rutin-N-mustard
Properties
Flash Point: 550.2°C
Boiling Point: 986.1°C at 760 mmHg
Density:1.72g/cm3
Refractive index:1.72
Flash Point: 550.2°C
Safety Data
 

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