4-Bromo-3-fluorobenzamide - CAS 759427-20-8
Catalog: |
BB071770 |
Product Name: |
4-Bromo-3-fluorobenzamide |
CAS: |
759427-20-8 |
Synonyms: |
4-Bromo-3-fluorobenzamide; 4-bromo-3-fluoro-benzamide; 4-bromo-3-fluorobenzamide, AldrichCPR |
IUPAC Name: | 4-bromo-3-fluorobenzamide |
Description: | 4-Bromo-3-fluorobenzamide |
Molecular Weight: | 218.02 |
Molecular Formula: | C7H5BrFNO |
Canonical SMILES: | C1=CC(=C(C=C1C(=O)N)F)Br |
InChI: | InChI=1S/C7H5BrFNO/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H2,10,11) |
InChI Key: | VKCJLZDBTNZHSV-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 216.95385 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 216.95385 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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