5-Bromo-2,4-dichloronitrobenzene - CAS 65001-80-1
Catalog: |
BB032613 |
Product Name: |
5-Bromo-2,4-dichloronitrobenzene |
CAS: |
65001-80-1 |
Synonyms: |
1-bromo-2,4-dichloro-5-nitrobenzene; 1-bromo-2,4-dichloro-5-nitrobenzene |
IUPAC Name: | 1-bromo-2,4-dichloro-5-nitrobenzene |
Description: | 5-Bromo-2,4-dichloronitrobenzene (CAS# 65001-80-1) is a useful research chemical. |
Molecular Weight: | 270.90 |
Molecular Formula: | C6H2BrCl2NO2 |
Canonical SMILES: | C1=C(C(=CC(=C1Br)Cl)Cl)[N+](=O)[O-] |
InChI: | InChI=1S/C6H2BrCl2NO2/c7-3-1-6(10(11)12)5(9)2-4(3)8/h1-2H |
InChI Key: | SAGMAWQXVPKKAP-UHFFFAOYSA-N |
LogP: | 4.18730 |
Publication Number | Title | Priority Date |
US-3523117-A | Dioxazine dyestuffs | 19630702 |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 268.8646 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 268.8646 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 45.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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