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22611-58-1 | Methane, bromochlorofluoro-, (S)- (9CI)
CAS No: 22611-58-1 Catalog No: AG001110 MDL No:
Product Description
Catalog Number:
AG001110
Chemical Name:
Methane, bromochlorofluoro-, (S)- (9CI)
CAS Number:
22611-58-1
Molecular Formula:
CHBrClF
Molecular Weight:
147.3740
IUPAC Name:
bromo-chloro-fluoromethane
InChI:
InChI=1S/CHBrClF/c2-1(3)4/h1H
InChI Key:
YNKZSBSRKWVMEZ-UHFFFAOYSA-N
SMILES:
F[C@H](Br)Cl
Properties
Complexity:
17.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.893g/mol
Formal Charge:
0
Heavy Atom Count:
4
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.371g/mol
Monoisotopic Mass:
145.893g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Progress toward the first observation of parity violation in chiral molecules by high-resolution laser spectroscopy. | Chirality 20101101 |
| Electrostatic chiral distinction: tetrahedral model dimers. | Chirality 20100701 |
| Absolute configuration of chirally deuterated neopentane. | Nature 20070329 |
| Surface enhanced Raman optical activity of molecules on orientationally averaged substrates: theory of electromagnetic effects. | The Journal of chemical physics 20060928 |
| Solvent effects on Raman optical activity spectra calculated using the polarizable continuum model. | The journal of physical chemistry. A 20060302 |
| Gas-chromatographic separation of tri(hetero)halogenomethane enantiomers. | Chirality 20051001 |
| Perturbational calculations of parity-violating effects in nuclear-magnetic-resonance parameters. | The Journal of chemical physics 20050801 |
| Recent experimental and theoretical developments towards the observation of parity violation (PV) effects in molecules by spectroscopy. | Organic & biomolecular chemistry 20050621 |
| Search for resolution of chiral fluorohalogenomethanes and parity-violation effects at the molecular level. | Chemphyschem : a European journal of chemical physics and physical chemistry 20030616 |
| The absolute configuration of bromochlorofluoromethane. | Angewandte Chemie (International ed. in English) 20021202 |
| Molecular chirality and the fundamental symmetries of physics: influence of parity violation on rovibrational frequencies and thermodynamic properties. | Chirality 20010101 |
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