2-Bromo-4-fluoro-1-methylbenzene - CAS 1422-53-3
Catalog: |
BB071716 |
Product Name: |
2-Bromo-4-fluoro-1-methylbenzene |
CAS: |
1422-53-3 |
Synonyms: |
2-Bromo-4-fluorotoluene; 2-Bromo-4-fluoro-1-methylbenzene; 4-fluoro-2-bromotoluene; Benzene, 2-bromo-4-fluoro-1-methyl-; 2-BROMO-4-FLUORO TOLUENE; 2-bromo-4-fluoro-1-methyl-benzene |
IUPAC Name: | 2-bromo-4-fluoro-1-methylbenzene |
Molecular Weight: | 189.03 |
Molecular Formula: | C7H6BrF |
Canonical SMILES: | CC1=C(C=C(C=C1)F)Br |
InChI: | InChI=1S/C7H6BrF/c1-5-2-3-6(9)4-7(5)8/h2-4H,1H3 |
InChI Key: | SFGFOJPGCOYQJK-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/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 |
Complexity: | 94.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.96369 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.96369 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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