(1H-Benzotriazol-1-yloxy)[tris(dimethylamino)]phosphonium hexafluorophosphate

Basic Information

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CAS Number

56602-33-6

Molecular Formula

C12H22F6N6OP2

Molecular Weight

442.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Insecticides

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

>130 °C (dec.)

Water Solubility

Soluble in methanol, acetone and dichloromethane. Insoluble in water.

Flash Point

138°C

Solubility

methanol: 25 mg/mL, clear

SMILES

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CN(C)[P+](N(C)C)(N(C)C)ON1C2=CC=CC=C2N=N1.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C12H22N6OP.F6P/c1-15(2)20(16(3)4,17(5)6)19-18-12-10-8-7-9-11(12)13-14-18;1-7(2,3,4,5)6/h7-10H,1-6H3;/q+1;-1

InChIKey

MGEVGECQZUIPSV-UHFFFAOYSA-N

LogP

4.60470

Complexity

368

Safety Information

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GHS Hazard Pictograms

H228

H315

H335

Hazard Statement

H228 Flammable solid
Flammable solids

H315 Causes skin irritation
Skin corrosion/irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 4.1 Class 4.1

Sensitiveness

Moisture & Light Sensitive

Synonyms & References

English

SB40668
1-benzotriazolyl-oxytris(dimethylamino)phosphonium hexafluorophosphate
(benzotriazol-1 yloxy)-tris(dimethylamino)-phosphoniumhexafluorophosphate
benzotriazol-1-yl-oxy-tris-(dimethylamino)-phosphoniumhexafluorophosphate
benzotriazol-1-yloxy-tris(dimethyl-amino) phosphonium hexafluorophosphate
benzotriazol-1-yloxy-tris(dimethylamino) phosphonium hexafluorophosphate
(Benzotriazol-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate, 97%
MFCD00011948
HY-Y0973
(1H-1,2,3-benzotriazol-1-yloxy)(tri(dimethylamino)) phosphonium hexafluorophosphate
B1651
benzotriazole-1-yloxy-tris(dimethylamino)phosphonium hexafluorophosphate
1H-1,2,3-benzotriazol-1-yloxy-tris(dimethylamino)-phosphonium hexafluorophosphate
AC-19125
[(1H-Benzotriazol-1-yl)oxy]tris(dimethylamino)phosphonium hexafluorophosphate
benzotriazol-1-yloxytris-(dimethylamino)phosphonium hexafluorophosphate
benzotriazol-1-yloxy -tris(dimethylamino)phosphonium hexafluorophosphate
benzotriazole-1-yloxytris(dimethylamino)-phosphonium hexaflurophosphate
SCHEMBL1497619
benzotriazole-1-yl-oxy-tris-(dimethylamino)phosphonium hexafluorophosphate
CS-D1436
(benzotriazole-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate
NSC367086
benzotriazol-1-yl-oxy-tris-(dimethylamino)phosphonium hexafluorophosphate
Phosphorus(1++), (1-hydroxy-1H-benzotriazolato-O)tris(N-methylmethanaminato)-, (beta-4)-, hexafluorophosphate(1-)
(benzotriazol-1-yloxy)tris(dimethylamino) phosphonium hexafluorophosphate
(Benzotriazol-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate
((1H-Benzo[d][1,2,3]triazol-1-yl)oxy)tris(dimethylamino)phosphonium hexafluorophosphate
(1H-1,2,3-benzotriazol-1-yloxy)[tris-(dimethylamino)]phosphonium hexafluorophosphate
Benzotriazol-1-yl-oxy-tris(dimethylamino) phosphonium hexafluorophosphate (BOP Reagent)
(1H-benzotriazol-1-yloxy)[tris(dimethylamino)]phosphonium hexafluorophosphate

MDL Number

MFCD00011948

Customs Code

29339980

FAQ

What is (1H-Benzotriazol-1-yloxy)[tris(dimethylamino)]phosphonium hexafluorophosphate (CAS: 56602-33-6)?

This compound, with the CAS number 56602-33-6, is a phosphonium salt containing a 1H-benzotriazol-1-yloxy group and a tris(dimethylamino) substituent. It is known for its strong nucleophilic properties and is commonly used as a catalyst in organic synthesis. The compound is a white solid at room temperature and is soluble in polar solvents.

What are the main uses of (1H-Benzotriazol-1-yloxy)[tris(dimethylamino)]phosphonium hexafluorophosphate (CAS: 56602-33-6)?

This compound is primarily used in pharmaceutical research as a nucleophilic reagent and catalyst. It also finds applications in the synthesis of various organic compounds, including drugs and agrochemicals. Due to its reactivity, it is valuable in chemical research for promoting reactions such as acylations and alkylations.

Is (1H-Benzotriazol-1-yloxy)[tris(dimethylamino)]phosphonium hexafluorophosphate (CAS: 56602-33-6) safe?

The safety of this compound depends on its handling and exposure conditions. It is generally considered safe when used in controlled laboratory settings, but proper protective equipment, such as gloves and goggles, should be worn. It is important to follow standard chemical safety protocols to minimize risks during storage and use.

How should (1H-Benzotriazol-1-yloxy)[tris(dimethylamino)]phosphonium hexafluorophosphate (CAS: 56602-33-6) be stored?

This compound should be stored in a cool, dry, and dark place, preferably at temperatures below 25°C. It should be kept in a sealed container to prevent moisture exposure and avoid contact with air. Storage in a well-ventilated area is recommended to ensure stability and maintain its chemical integrity.