4-Bromobenzamide - CAS 698-67-9
Catalog: |
BB033995 |
Product Name: |
4-Bromobenzamide |
CAS: |
698-67-9 |
Synonyms: |
4-bromobenzamide |
IUPAC Name: | 4-bromobenzamide |
Description: | 4-Bromobenzamide (CAS# 698-67-9) is a useful research chemical. |
Molecular Weight: | 200.03 |
Molecular Formula: | C7H6BrNO |
Canonical SMILES: | C1=CC(=CC=C1C(=O)N)Br |
InChI: | InChI=1S/C7H6BrNO/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H2,9,10) |
InChI Key: | ZRWNRAJCPNLYAK-UHFFFAOYSA-N |
Boiling Point: | 309.9 ℃ at 760 mmHg |
Melting Point: | 189-194 ℃ |
Purity: | 98 % |
Density: | 1.609 g/cm3 |
Appearance: | White fine crystalline powder |
MDL: | MFCD00007991 |
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-112961079-A | Method for dehydrating primary amide into nitriles by cobalt catalysis | 20210304 |
CN-112279810-A | 6-oxo-5, 6-dihydrophenanthridine-4-formamide compound, preparation method, pharmaceutical composition and application | 20201225 |
CN-112279810-B | 6-oxo-5, 6-dihydrophenanthridine-4-formamide compound, preparation method, pharmaceutical composition and application | 20201225 |
CN-112321448-A | Preparation method of amide-containing Mannich type compound | 20201110 |
CN-112142792-A | Novel method for constructing nitrogen-phosphorus double bonds through visible light catalysis | 20200916 |
PMID | Publication Date | Title | Journal |
18950667 | 20090105 | Cutaneous biotransformation of N-(4-bromobenzoyl)-S,S-dimethyliminosulfurane and its product, 4-bromobenzamide, leading to percutaneous penetration enhancement of drugs: initial evidence using hydrocortisone | Journal of controlled release : official journal of the Controlled Release Society |
Complexity: | 130 |
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: | 1.8 |
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