476722
3-Bromo-1,1,1-trifluoro-2-propanol
96%
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About This Item
Linear Formula:
BrCH2CH(OH)CF3
CAS Number:
Molecular Weight:
192.96
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
96%
assay
96%
refractive index
n20/D 1.4 (lit.)
bp
124.5 °C/743 mmHg (lit.)
density
1.861 g/mL at 25 °C (lit.)
SMILES string
OC(CBr)C(F)(F)F
InChI
1S/C3H4BrF3O/c4-1-2(8)3(5,6)7/h2,8H,1H2
InChI key
VBHIIZIQRDVGDH-UHFFFAOYSA-N
General description
3-Bromo-1,1,1-trifluoro-2-propanol (3-bromo-1,1,1-trifluoropropan-2-ol, BTFP) is a brominated saturated alcohol. It behaves as a thiol-reactive trifluoromethyl probe. Its effective chemical shift dispersion under conditions of varying polarity has been studied. The photodissociation dynamics of BTFP has been investigated by various methods.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
109.4 °F - closed cup
flash_point_c
43 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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Photodissociation of 3-Bromo-1, 1, 1-trifluoro-2-propanol at 193 nm: Laser-Induced Fluorescence Detection of OH (?''= 0, J'').
Indulkar YN, et al.
The Journal of Physical Chemistry A, 113(30), 8462-8470 (2009)
A comparison of chemical shift sensitivity of trifluoromethyl tags: optimizing resolution in 19F NMR studies of proteins.
Ye L, et al.
Journal of Biomolecular Nmr, 62(1), 97-103 (2015)
The periodically forced conversion of 2, 3-epoxy-1-propanol to glycerine: A theoretical analysis.
Rehmus P, et al.
J. Chem. Phys. , 78(12), 7241-7251 (1983)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 476722-5G | 04061837009402 |