2-Chloro-6-fluoronitrobenzene - CAS 64182-61-2
Catalog: |
BB032392 |
Product Name: |
2-Chloro-6-fluoronitrobenzene |
CAS: |
64182-61-2 |
Synonyms: |
1-chloro-3-fluoro-2-nitrobenzene; 1-chloro-3-fluoro-2-nitrobenzene |
IUPAC Name: | 1-chloro-3-fluoro-2-nitrobenzene |
Description: | 2-Chloro-6-fluoronitrobenzene (CAS# 64182-61-2) is a useful research chemical. |
Molecular Weight: | 175.54 |
Molecular Formula: | C6H3ClFNO2 |
Canonical SMILES: | C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])F |
InChI: | InChI=1S/C6H3ClFNO2/c7-4-2-1-3-5(8)6(4)9(10)11/h1-3H |
InChI Key: | GOIUPLBHNRTTIO-UHFFFAOYSA-N |
Boiling Point: | 245.1 ℃ at 760 mmHg |
Density: | 1.494 g/cm3 |
Appearance: | Colorless to yellow liquid or solid or powder |
MDL: | MFCD06658264 |
LogP: | 2.91050 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110590570-A | Method for preparing halogenated p-aminophenol by catalytic hydrogenation of non-para-halogenated nitrobenzene | 20191010 |
CN-111848601-A | Compound containing condensed ring, application thereof and pharmaceutical composition containing compound | 20190430 |
WO-2020221074-A1 | Compound containing fused ring, use thereof and pharmaceutical composition containing same | 20190430 |
WO-2019166639-A1 | Substituted benzodiazoles and use thereof in therapy | 20180301 |
CN-112074511-A | Substituted benzodiazoles and their use in therapy | 20180301 |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.9836342 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.9836342 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 45.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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