3,4-Dibromonitrobenzene - CAS 5411-50-7
Catalog: |
BB028504 |
Product Name: |
3,4-Dibromonitrobenzene |
CAS: |
5411-50-7 |
Synonyms: |
1,2-dibromo-4-nitrobenzene; 1,2-dibromo-4-nitrobenzene |
IUPAC Name: | 1,2-dibromo-4-nitrobenzene |
Description: | 3,4-Dibromonitrobenzene (CAS# 5411-50-7) is a useful research chemical. |
Molecular Weight: | 280.90 |
Molecular Formula: | C6H3Br2NO2 |
Canonical SMILES: | C1=CC(=C(C=C1[N+](=O)[O-])Br)Br |
InChI: | InChI=1S/C6H3Br2NO2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H |
InChI Key: | DLLDRYLYVHKDKK-UHFFFAOYSA-N |
LogP: | 3.64300 |
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-112094248-A | Substituted benzothiazole compound and application thereof | 20200917 |
CN-110981702-A | Efficient synthesis method of 2, 3-dibromophenol or derivatives thereof | 20191105 |
CN-108191782-A | The preparation method of a kind of monosubstituted benzotriazole small molecule | 20171215 |
CN-105669590-A | Catalyst-free technique for synthesizing phenothiazine drug intermediate | 20160308 |
US-2017186972-A1 | Organic electroluminescent compound and organic photoelectric apparatus thereof | 20151225 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 280.85100 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 278.85305 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 45.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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