(3,5-Dichlorophenyl)difluoroacetic acid - CAS 1260762-88-6
Catalog: |
BB063044 |
Product Name: |
(3,5-Dichlorophenyl)difluoroacetic acid |
CAS: |
1260762-88-6 |
Synonyms: |
(3,5-Dichlorophenyl)difluoroacetic acid; 2-(3,5-dichlorophenyl)-2,2-difluoroacetic acid; (3,5-Dichlorophenyl)difluoroaceticacid |
IUPAC Name: | 2-(3,5-dichlorophenyl)-2,2-difluoroacetic acid |
Description: | (3,5-Dichlorophenyl)difluoroacetic acid |
Molecular Weight: | 241.01 |
Molecular Formula: | C8H4Cl2F2O2 |
Canonical SMILES: | C1=C(C=C(C=C1Cl)Cl)C(C(=O)O)(F)F |
InChI: | InChI=1S/C8H4Cl2F2O2/c9-5-1-4(2-6(10)3-5)8(11,12)7(13)14/h1-3H,(H,13,14) |
InChI Key: | MUAXKRKJDNBVTD-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 225 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 239.9556411 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 239.9556411 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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