2,4-Dichloro-5-fluoro-3-nitrobenzoic acid - CAS 106809-14-7
Catalog: |
BB001925 |
Product Name: |
2,4-Dichloro-5-fluoro-3-nitrobenzoic acid |
CAS: |
106809-14-7 |
Synonyms: |
2,4-dichloro-5-fluoro-3-nitrobenzoic acid |
IUPAC Name: | 2,4-dichloro-5-fluoro-3-nitrobenzoic acid |
Description: | 2,4-Dichloro-5-fluoro-3-nitrobenzoic acid (CAS# 106809-14-7) is a useful research chemical. |
Molecular Weight: | 254.00 |
Molecular Formula: | C7H2Cl2FNO4 |
Canonical SMILES: | C1=C(C(=C(C(=C1F)Cl)[N+](=O)[O-])Cl)C(=O)O |
InChI: | InChI=1S/C7H2Cl2FNO4/c8-4-2(7(12)13)1-3(10)5(9)6(4)11(14)15/h1H,(H,12,13) |
InChI Key: | PCSAPCNEJUEIGU-UHFFFAOYSA-N |
Boiling Point: | 390.4 ℃ at 760 mmHg |
Melting Point: | 193-197 ℃ |
Purity: | 98 % |
Density: | 1.789 g/cm3 |
Appearance: | White to light yellow crystal powder |
Storage: | Sealed in dry, 2-8 ℃ |
MDL: | MFCD03427137 |
LogP: | 3.26210 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110156637-A | A kind of preparation method of the chloro- 3- cyano -5- fluobenzoic acid of 2,4- bis- | 20190618 |
CN-104945264-A | One pot synthetic method of 2,4-dichloro-3-nitro-5-fluoro-benzoic acid | 20150605 |
CN-104744305-B | A kind of synthetic method of 2,4-bis-chloro-3-cyano group-5-fluobenzoic acid | 20150313 |
CN-104713981-A | Content calculation method of 2,4-dichloro-3-nitro-5-fluorobenzoyl chloride generated by acylation reaction | 20140521 |
CN-103922942-A | Preparation method of 2, 4-dichloro-5-fluoro-3-nitrobenzoic acid | 20140424 |
Complexity: | 285 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 252.9344911 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 252.9344911 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 83.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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