BOP reagent
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BOP reagent
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CAS No:
56602-33-6
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Formula:
C12H22N6OP.F6P
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Chemical Name:
BOP reagent
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Synonyms:
Phosphorus(1+),[1-(hydroxy-κO)-1H-benzotriazolato]tris(N-methylmethanaminato)-,(T-4)-,hexafluorophosphate(1-) (1:1);Phosphorus(1+),(1-hydroxy-1H-benzotriazolato-O)tris(N-methylmethanaminato)-,(T-4)-,hexafluorophosphate(1-);Phosphate(1-),hexafluoro-,(T-4)-(1-hydroxy-1H-benzotriazolato-O)tris(N-methylmethanaminato)phosphorus(1+);1H-Benzotriazole,1-hydroxy-,phosphorus complex;Methanamine,N-methyl-,phosphorus complex;BOP hexafluorophosphate;BOP reagent;Le BOP;BOP;(Benzotriazol-1-yloxy)tris(dimethylamino) hexafluorophosphate;Benzotriazol-1-yloxytris(dimethylamino)phosphonium hexafluorophosphate;2-(1H-Benzotriazol-1-yl)tris(dimethylamino)phosphonium hexafluorophosphate;1H-Benzotriazol-1-yloxytris(dimethylamino)phosphonium hexafluorophosphate;Castro's reagent;Castro reagent;1616484-49-1
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CAS No:
Characteristics
49.7
4.60470
White to off-white Powder
>130 °C (dec.)(lit.)
138°C
soluble in methanol, acetone and dichloromethane. Insoluble in water.methanol: 25 mg/mL, clear
2-8°C
Safety Information
4.1
UN 1325 4.1/PG 2
3
37/38-44-36/37/38-11-2
24/25-37/39-36-26-35-36/37/39
Xi,E,F
Irritant
Stable under normal temperatures and pressures.
P210-P261
H228-H315-H335
|Warning|H228 (81.48%): Flammable solid [Danger Flammable solids]|P210, P240, P241, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P405, and P501|Aggregated GHS information provided by 54 companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
BOP reagent Use and Manufacturing
A peptide coupling reagent.Can be used in the preparation of phenyl esters of amino acids which have been shown to be valuable as blocked derivatives of amino acids in the field of peptide synthesis
Computed Properties
Molecular Weight:442.28
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:5
Exact Mass:442.12345231
Monoisotopic Mass:442.12345231
Topological Polar Surface Area:49.7
Heavy Atom Count:27
Complexity:368
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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