3-[4-(Bromomethyl)phenyl]-3-(trifluoromethyl)diazirine - CAS 92367-11-8
Catalog: |
BB071210 |
Product Name: |
3-[4-(Bromomethyl)phenyl]-3-(trifluoromethyl)diazirine |
CAS: |
92367-11-8 |
Synonyms: |
4-[3-(Trifluoromethyl)-3H-diazirin-3-yl]benzyl Bromide; 3-(4-(Bromomethyl)phenyl)-3-(trifluoromethyl)-3H-diazirine; 3-[4-(Bromomethyl)phenyl]-3-(trifluoromethyl)-3H-diazirine; 3-[4-(bromomethyl)phenyl]-3-(trifluoromethyl)diazirine; 3H-Diazirine, 3-[4-(bromomethyl)phenyl]-3-(trifluoromethyl)-; 3-[4-(bromomethyl)phenyl]-3-(trifluoromethyl)-3H-diazirene |
IUPAC Name: | 3-[4-(bromomethyl)phenyl]-3-(trifluoromethyl)diazirine |
Molecular Weight: | 279.06 |
Molecular Formula: | C9H6BrF3N2 |
Canonical SMILES: | C1=CC(=CC=C1CBr)C2(N=N2)C(F)(F)F |
InChI: | InChI=1S/C9H6BrF3N2/c10-5-6-1-3-7(4-2-6)8(14-15-8)9(11,12)13/h1-4H,5H2 |
InChI Key: | BCFUQXOZHPIAPS-UHFFFAOYSA-N |
GHS Hazard Statement: | H290 (100%): May be corrosive to metals [Warning Corrosive to Metals] |
Precautionary Statement: | P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, and P501 |
Signal Word: | Danger |
Complexity: | 263 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 277.96665 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 277.96665 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 24.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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