4-[(2,2,3,3-Tetrafluoropropoxy)methyl]benzoic acid - CAS 444151-68-2
Catalog: |
BB045133 |
Product Name: |
4-[(2,2,3,3-Tetrafluoropropoxy)methyl]benzoic acid |
CAS: |
444151-68-2 |
Synonyms: |
4-[(2,2,3,3-tetrafluoropropoxy)methyl]benzoicacid |
IUPAC Name: | 4-(2,2,3,3-tetrafluoropropoxymethyl)benzoic acid |
Description: | 4-[(2,2,3,3-Tetrafluoropropoxy)methyl]benzoic acid (CAS# 444151-68-2 ) is a useful research chemical. |
Molecular Weight: | 266.19 |
Molecular Formula: | C11H10F4O3 |
Canonical SMILES: | C1=CC(=CC=C1COCC(C(F)F)(F)F)C(=O)O |
InChI: | InChI=1S/C11H10F4O3/c12-10(13)11(14,15)6-18-5-7-1-3-8(4-2-7)9(16)17/h1-4,10H,5-6H2,(H,16,17) |
InChI Key: | WBQDFRPLOUVDKJ-UHFFFAOYSA-N |
Complexity: | 276 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.05660683 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.05660683 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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