2-Chloro-3,4-dimethyl-1-nitrobenzene - CAS 52328-28-6
Catalog: |
BB027787 |
Product Name: |
2-Chloro-3,4-dimethyl-1-nitrobenzene |
CAS: |
52328-28-6 |
Synonyms: |
3-chloro-1,2-dimethyl-4-nitrobenzene; 3-chloro-1,2-dimethyl-4-nitrobenzene |
IUPAC Name: | 3-chloro-1,2-dimethyl-4-nitrobenzene |
Description: | 2-Chloro-3,4-dimethyl-1-nitrobenzene (CAS# 52328-28-6 ) is a useful research chemical. |
Molecular Weight: | 185.61 |
Molecular Formula: | C8H8ClNO2 |
Canonical SMILES: | CC1=C(C(=C(C=C1)[N+](=O)[O-])Cl)C |
InChI: | InChI=1S/C8H8ClNO2/c1-5-3-4-7(10(11)12)8(9)6(5)2/h3-4H,1-2H3 |
InChI Key: | LGVZYDQFUPEYNJ-UHFFFAOYSA-N |
LogP: | 3.38820 |
Publication Number | Title | Priority Date |
AU-2009275471-A1 | Insecticidal benzenedicarboxamide derivative | 20080731 |
CN-102171190-A | Insecticidal benzenedicarboxamide derivative | 20080731 |
EP-2318374-A2 | Insecticidal benzenedicarboxamide derivative | 20080731 |
JP-2010030970-A | Insecticidal benzenedicarboxamide derivatives | 20080731 |
JP-2011529460-A | Insecticidal benzenedicarboxamide derivatives | 20080731 |
Complexity: | 180 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.0243562 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.0243562 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 45.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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