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About This Item
Linear Formula:
C20H27N4O12P · NH3
CAS Number:
Molecular Weight:
563.45
UNSPSC Code:
41106305
PubChem Substance ID:
MDL number:
assay
~99%
form
solid
storage temp.
−20°C
SMILES string
N.CC1=CN([C@H]2C[C@H](O)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3CO)N4C=C(C)C(=O)NC4=O)O2)C(=O)NC1=O
InChI
1S/C20H27N4O12P.H3N/c1-9-5-23(19(29)21-17(9)27)15-3-11(26)14(35-15)8-33-37(31,32)36-12-4-16(34-13(12)7-25)24-6-10(2)18(28)22-20(24)30;/h5-6,11-16,25-26H,3-4,7-8H2,1-2H3,(H,31,32)(H,21,27,29)(H,22,28,30);1H3/t11-,12-,13+,14+,15+,16+;/m0./s1
InChI key
TUUIEHHWVRHMDA-JQQQFMHGSA-N
Storage Class
11 - Combustible Solids
WGK
WGK 3
Flash Point (°F)
Not applicable
Flash Point (°C)
Not applicable
PPE (personal protective equipment)
Eyeshields, Gloves, type N95 (US)
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