1-Fluoro-2-iodo-4-nitrobenzene - CAS 177363-10-9
Catalog: |
BB013283 |
Product Name: |
1-Fluoro-2-iodo-4-nitrobenzene |
CAS: |
177363-10-9 |
Synonyms: |
1-fluoro-2-iodo-4-nitrobenzene; 1-fluoro-2-iodo-4-nitrobenzene |
IUPAC Name: | 1-fluoro-2-iodo-4-nitrobenzene |
Description: | 1-Fluoro-2-iodo-4-nitrobenzene (CAS# 177363-10-9) is a useful research chemical. |
Molecular Weight: | 267.00 |
Molecular Formula: | C6H3FINO2 |
Canonical SMILES: | C1=CC(=C(C=C1[N+](=O)[O-])I)F |
InChI: | InChI=1S/C6H3FINO2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H |
InChI Key: | XSFIPDPCQOJJFR-UHFFFAOYSA-N |
LogP: | 2.86170 |
GHS Hazard Statement: | H302 (100%): 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 |
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KR-20200089219-A | Aryl or heteroaryl derivatives, and pharmaceutical composition thereof for use in preventing or treating kinase-related disease | 20190115 |
WO-2020149553-A1 | Aryl or heteroaryl derivative, and pharmaceutical composition comprising same as active ingredient for treatment of kinase-related disease | 20190115 |
US-2020140459-A1 | Heterocyclic compounds as bet inhibitors | 20181030 |
CN-113226322-A | Heterocyclic compounds as BET inhibitors | 20181030 |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.91925 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.91925 |
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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