2'-Bromo-2,2,2-trifluoroacetophenone - CAS 244229-34-3
Catalog: |
BB018472 |
Product Name: |
2'-Bromo-2,2,2-trifluoroacetophenone |
CAS: |
244229-34-3 |
Synonyms: |
1-(2-bromophenyl)-2,2,2-trifluoroethanone |
IUPAC Name: | 1-(2-bromophenyl)-2,2,2-trifluoroethanone |
Description: | 2'-Bromo-2,2,2-trifluoroacetophenone (CAS# 244229-34-3) is a useful research chemical. |
Molecular Weight: | 253.02 |
Molecular Formula: | C8H4BrF3O |
Canonical SMILES: | C1=CC=C(C(=C1)C(=O)C(F)(F)F)Br |
InChI: | InChI=1S/C8H4BrF3O/c9-6-4-2-1-3-5(6)7(13)8(10,11)12/h1-4H |
InChI Key: | VNAWTGXXPNWISR-UHFFFAOYSA-N |
Purity: | 95 % |
MDL: | MFCD07380806 |
LogP: | 3.19410 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021024473-A1 | Substituted dihydrobenzoxazinones, dihydroquinolones, and methods of their use and synthesis | 20190703 |
CN-108912020-A | Ao Dangka is replaced and its preparation method of intermediate | 20180605 |
EP-3222712-A1 | Alcohol dehydrogenase from pichia pastoris and use thereof | 20160322 |
CN-105153329-A | Acetophenone type photoinitiators using fluorene as conjugated structure as well as preparation method and application of acetophenone type photoinitiators | 20150809 |
CN-105153329-B | Acetophenone type photoinitiators using fluorene as conjugated structure as well as preparation method and application of acetophenone type photoinitiators | 20150809 |
Complexity: | 202 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 251.93976 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 251.93976 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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