1-(2,5-Difluorophenyl)cyclobutanecarboxylic Acid - CAS 1260752-10-0
Catalog: |
BB006359 |
Product Name: |
1-(2,5-Difluorophenyl)cyclobutanecarboxylic Acid |
CAS: |
1260752-10-0 |
Synonyms: |
1-(2,5-difluorophenyl)-1-cyclobutanecarboxylic acid; 1-(2,5-difluorophenyl)cyclobutane-1-carboxylic acid |
IUPAC Name: | 1-(2,5-difluorophenyl)cyclobutane-1-carboxylic acid |
Description: | 1-(2,5-Difluorophenyl)cyclobutanecarboxylic Acid (CAS# 1260752-10-0 ) is a useful research chemical. |
Molecular Weight: | 212.19 |
Molecular Formula: | C11H10F2O2 |
Canonical SMILES: | C1CC(C1)(C2=C(C=CC(=C2)F)F)C(=O)O |
InChI: | InChI=1S/C11H10F2O2/c12-7-2-3-9(13)8(6-7)11(10(14)15)4-1-5-11/h2-3,6H,1,4-5H2,(H,14,15) |
InChI Key: | AOOXECYNGJSYAV-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 263 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.06488588 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.06488588 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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