4-Bromo-2-nitrophenol - CAS 7693-52-9
Catalog: |
BB035758 |
Product Name: |
4-Bromo-2-nitrophenol |
CAS: |
7693-52-9 |
Synonyms: |
4-bromo-2-nitrophenol |
IUPAC Name: | 4-bromo-2-nitrophenol |
Description: | 4-Bromo-2-nitrophenol (CAS# 7693-52-9) is a useful research chemical. |
Molecular Weight: | 218.00 |
Molecular Formula: | C6H4BrNO3 |
Canonical SMILES: | C1=CC(=C(C=C1Br)[N+](=O)[O-])O |
InChI: | InChI=1S/C6H4BrNO3/c7-4-1-2-6(9)5(3-4)8(10)11/h1-3,9H |
InChI Key: | CUTFAPGINUFNQM-UHFFFAOYSA-N |
Boiling Point: | 259 ℃ |
Melting Point: | 87-94 ℃ |
Purity: | 98 % |
Density: | 1.881 g/cm3 |
Appearance: | Yellow crystalline powder or crystals |
Storage: | Keep tightly closed. Store in a cool dry place. |
MDL: | MFCD00082540 |
LogP: | 2.58610 |
GHS Hazard Statement: | H302+H332 (88.64%): Harmful if swallowed or if inhaled [Warning Acute toxicity, oral; acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112209894-A | 5-aryl substituted 2-aminobenzoxazole derivative, preparation method and application thereof | 20201023 |
CN-111302956-A | Preparation method of 4-bromo-2-aminophenol | 20200414 |
WO-2021094763-A1 | Erap1 modulators | 20191114 |
WO-2021055627-A1 | Substituted n-heterocyclic carboxamides as acid ceramidase inhibitors and their use as medicaments | 20190917 |
WO-2021021951-A1 | Wdr5-myc inhibitors | 20190729 |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 216.93746 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 216.93746 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 66 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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