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2,4,6-Trinitrophenylglutathione
[CAS# 86386-47-2]

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CAS#: 86386-47-2
Product: 2,4,6-Trinitrophenylglutathione
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Identification
Name 2,4,6-Trinitrophenylglutathione
Synonyms Tnp-glutathione; 2,4,6-Trinitrophenylglutathione
Molecular Structure CAS#: 86386-47-2, 2,4,6-Trinitrophenylglutathione
Molecular Formula C26H33N9O18S2
Molecular Weight 823.72
CAS Registry Number 86386-47-2
SMILES O=C(N(c1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O)CC(=O)O)[C@@H](NC(=O)CC[C@@H](C(=O)O)N)CSSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N
InChI 1S/C26H33N9O18S2/c27-12(25(44)45)1-3-18(36)30-14(23(42)29-7-20(38)39)9-54-55-10-15(31-19(37)4-2-13(28)26(46)47)24(43)32(8-21(40)41)22-16(34(50)51)5-11(33(48)49)6-17(22)35(52)53/h5-6,12-15H,1-4,7-10,27-28H2,(H,29,42)(H,30,36)(H,31,37)(H,38,39)(H,40,41)(H,44,45)(H,46,47)/t12-,13-,14-,15-/m0/s1
InChIKey FFQZVOHBBONILO-AJNGGQMLSA-N
Properties
Density 1.68g/cm3 (Cal.)
Boiling point 1303.261°C at 760 mmHg (Cal.)
Flash point 741.985°C (Cal.)
Market Analysis Reports
List of Reports Available for 2,4,6-Trinitrophenylglutathione
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