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Merck
CN

476722

3-溴-1,1,1-三氟-2-丙醇

96%

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线性分子式:
BrCH2CH(OH)CF3
化学文摘社编号:
分子量:
192.96
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
96%
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InChI

1S/C3H4BrF3O/c4-1-2(8)3(5,6)7/h2,8H,1H2

SMILES string

OC(CBr)C(F)(F)F

InChI key

VBHIIZIQRDVGDH-UHFFFAOYSA-N

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.)

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.

pictograms

FlameExclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

存储类别

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

法规信息

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历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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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)
Photodissociation dynamics of 3-bromo-1,1,1-trifluoro-2-propanol and 2-(bromomethyl) hexafluoro-2-propanol at 234 nm: Resonance-enhanced multiphoton ionization detection of Br (2Pj).
Indulkar YN, et al.
J. Chem. Phys. , 134(19), 194313-194313 (2011)
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)

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