Methyl 2-(4-Chloro-3-nitrophenyl)acetate - CAS 300355-23-1
Catalog: |
BB020417 |
Product Name: |
Methyl 2-(4-Chloro-3-nitrophenyl)acetate |
CAS: |
300355-23-1 |
Synonyms: |
2-(4-chloro-3-nitrophenyl)acetic acid methyl ester; methyl 2-(4-chloro-3-nitrophenyl)acetate |
IUPAC Name: | methyl 2-(4-chloro-3-nitrophenyl)acetate |
Description: | Methyl 2-(4-Chloro-3-nitrophenyl)acetate (CAS# 300355-23-1 ) is a useful research chemical. |
Molecular Weight: | 229.62 |
Molecular Formula: | C9H8ClNO4 |
Canonical SMILES: | COC(=O)CC1=CC(=C(C=C1)Cl)[N+](=O)[O-] |
InChI: | InChI=1S/C9H8ClNO4/c1-15-9(12)5-6-2-3-7(10)8(4-6)11(13)14/h2-4H,5H2,1H3 |
InChI Key: | LOJNXJAUOTWCJE-UHFFFAOYSA-N |
LogP: | 2.48690 |
Publication Number | Title | Priority Date |
US-2009312558-A1 | Process for the preparation of arylcyclopropoane carboxylic carbonitriles, and compounds derived therefrom | 20080613 |
WO-2009150660-A1 | A process for the preparation of arylcyclopropane carboxylic carbonitriles, and compounds derived therefrom | 20080613 |
AU-2004274324-A1 | Carboxylic acid compounds and medicinal compositions containing the same as the active ingredient | 20030917 |
AU-2004274324-B2 | Carboxylic acid compounds and medicinal compositions containing the same as the active ingredient | 20030917 |
CA-2539070-C | Carboxylic acid compounds and medicinal compositions containing the same as the active ingredient | 20030917 |
Complexity: | 253 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.0141854 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.0141854 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 72.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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