M-6-G TRIFLUOROACETATE-HYDRATE

CAS No.
20290-10-2
CCD No.
CCD00305606
Formula
C23 H27 N O9 . C2 H F3 O2 . H2 O
MolWeight
593.501

Basic Information

Product Name: M-6-G TRIFLUOROACETATE-HYDRATE
CAS: 20290-10-2
English Synonyms: M-6-G TRIFLUOROACETATE-HYDRATE ; MORPHINE-6-BETA-D-GLUCURONIDE TRIFLUOROACETATE-HYDRATE
MDL Number.: MFCD02259004
H bond acceptor: 10
H bond donor: 5
Smile: CN1CC[C@]23c4c5ccc(c4O[C@H]2[C@H](C=C[C@H]3[C@H]1C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)O.C(=O)(C(F)(F)F)O.O
InChi: InChI=1S/C23H27NO9.C2HF3O2.H2O/c1-24-7-6-23-10-3-5-13(31-22-17(28)15(26)16(27)19(33-22)21(29)30)20(23)32-18-12(25)4-2-9(14(18)23)8-11(10)24;3-2(4,5)1(6)7;/h2-5,10-11,13,15-17,19-20,22,25-28H,6-8H2,1H3,(H,29,30);(H,6,7);1H2/t10-,11+,13-,15-,16-,17+,19-,20-,22+,23-;;/m0../s1
InChiKey: InChIKey=NPLIOLIPPNBXIK-WFLHAITMSA-N

Property

Melting Point: MELTING POINT [DEG C]: 232 +/- 2
Physical Property: OPTICAL ROTATION [ALPHA](25/D) [DEG] (CONC, SOLVENT): - 160 +/- 2 (1.0, H2O)
UV LAMBDA MAX [NM] (EPSILON MOL, SOLVENT): 285.6 ()
Comments: APPEARANCE: LYOPHILIZED WHITE POWDER
HPLC PURITY [%] OF TYPICAL LOT: 99.51
HPLC PURITY [%]: >98.5
IR: IDENTICAL TO REFERENCE
Specification: DRUG REFERENCE STANDARD
Information: CALCULATED TRIFLUOROACETATE CONTENT [%]: 9.71
FREE BASE CONTENT [%]: >74.0
WATER CONTENT [%]: 11.84 +/- 0.4

Safety information

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