2-Bromobenzamide - CAS 4001-73-4
Catalog: |
BB024257 |
Product Name: |
2-Bromobenzamide |
CAS: |
4001-73-4 |
Synonyms: |
2-bromobenzamide |
IUPAC Name: | 2-bromobenzamide |
Description: | 2-Bromobenzamide (CAS# 4001-73-4) is a useful research chemical. |
Molecular Weight: | 200.03 |
Molecular Formula: | C7H6BrNO |
Canonical SMILES: | C1=CC=C(C(=C1)C(=O)N)Br |
InChI: | InChI=1S/C7H6BrNO/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H2,9,10) |
InChI Key: | NHNAEZDWNCRWRW-UHFFFAOYSA-N |
Boiling Point: | 298 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.609 g/cm3 |
Appearance: | Beige powder |
MDL: | MFCD00007969 |
LogP: | 2.24830 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111875515-A | Method for generating amide by catalyzing primary amine with metal complex | 20200904 |
CN-112010777-A | Method for continuously preparing nitrile from amide in pipeline reactor | 20200820 |
CN-112028726-A | Method for continuously preparing nitrile from amide | 20200818 |
CN-112028793-A | Method for preparing nitrile by bismuth complex catalytic amide dehydration | 20200817 |
CN-111620837-A | Cedar ketone thiazole amide compound, and preparation method and application thereof | 20200629 |
PMID | Publication Date | Title | Journal |
22443210 | 20120420 | Concise approach to benzisothiazol-3(2H)-one via copper-catalyzed tandem reaction of o-bromobenzamide and potassium thiocyanate in water | The Journal of organic chemistry |
21954114 | 20111104 | Solvent/base effects in the selective domino synthesis of phenanthridinones that involves high-valent palladium species: experimental and theoretical studies | Chemistry (Weinheim an der Bergstrasse, Germany) |
19950912 | 20100101 | Selective unusual Pd-mediated biaryl coupling reactions: solvent effects with carbonate bases | Organic letters |
19226134 | 20090319 | Assembly of substituted 3-methyleneisoindolin-1-ones via a CuI/l-proline-catalyzed domino reaction process of 2-bromobenzamides and terminal alkynes | Organic letters |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.96328 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.96328 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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