4,4-Difluoro-3-methyloxolane-3-carboxylic Acid - CAS 1782346-79-5
Catalog: |
BB068504 |
Product Name: |
4,4-Difluoro-3-methyloxolane-3-carboxylic Acid |
CAS: |
1782346-79-5 |
Synonyms: |
4, 4- Difluorotetrahydro- 3- methyl-3- furancarboxylic Acid |
IUPAC Name: | 4,4-difluoro-3-methyloxolane-3-carboxylic acid |
Description: | 4,4-Difluoro-3-methyloxolane-3-carboxylic Acid (cas# 1782346-79-5) is a useful research chemical. |
Molecular Weight: | 166.12 |
Molecular Formula: | C6H8F2O3 |
Canonical SMILES: | CC1(COCC1(F)F)C(=O)O |
InChI: | InChI=1S/C6H8F2O3/c1-5(4(9)10)2-11-3-6(5,7)8/h2-3H2,1H3,(H,9,10) |
InChI Key: | QURFLSSIPXGDCR-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: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.04415044 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.04415044 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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