2,3,4-Trifluorobenzyl bromide - CAS 157911-55-2
Catalog: |
BB011364 |
Product Name: |
2,3,4-Trifluorobenzyl bromide |
CAS: |
157911-55-2 |
Synonyms: |
1-(bromomethyl)-2,3,4-trifluorobenzene |
IUPAC Name: | 1-(bromomethyl)-2,3,4-trifluorobenzene |
Description: | 2,3,4-Trifluorobenzyl bromide (CAS# 157911-55-2) is a useful research chemical. |
Molecular Weight: | 225.01 |
Molecular Formula: | C7H4BrF3 |
Canonical SMILES: | C1=CC(=C(C(=C1CBr)F)F)F |
InChI: | InChI=1S/C7H4BrF3/c8-3-4-1-2-5(9)7(11)6(4)10/h1-2H,3H2 |
InChI Key: | DGSXDQVPGXFOAN-UHFFFAOYSA-N |
Boiling Point: | 191.4 ℃ at 760 mmHg |
Melting Point: | 21 ℃ |
Purity: | 95 % |
Density: | 1.71 g/cm3 |
MDL: | MFCD00061233 |
LogP: | 2.99880 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2020081572-A1 | Transcriptional enhanced associate domain (tead) transcription factor inhibitors and uses thereof | 20181015 |
CN-112262128-A | Method for forming aryl carbon-nitrogen bond by illumination and photoreactor for carrying out the reaction | 20180508 |
AU-2018338855-A1 | Heterocyclic compound | 20170929 |
CA-3076477-A1 | Heterocyclic compound | 20170929 |
CN-111148746-A | Heterocyclic compounds | 20170929 |
Complexity: | 131 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.94485 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.94485 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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