2-fluoro-3-(oxan-4-yl)propanoic acid - CAS 1515583-69-3
Catalog: |
BB065364 |
Product Name: |
2-fluoro-3-(oxan-4-yl)propanoic acid |
CAS: |
1515583-69-3 |
Synonyms: |
2-fluoro-3-(oxan-4-yl)propanoic acid; 2-Fluoro-3-(tetrahydro-2H-pyran-4-yl)propanoic acid |
IUPAC Name: | 2-fluoro-3-(oxan-4-yl)propanoic acid |
Description: | 2-fluoro-3-(oxan-4-yl)propanoic acid (cas# 1515583-69-3) is a useful research chemical. |
Molecular Weight: | 176.19 |
Molecular Formula: | C8H13FO3 |
Canonical SMILES: | C1COCCC1CC(C(=O)O)F |
InChI: | InChI=1S/C8H13FO3/c9-7(8(10)11)5-6-1-3-12-4-2-6/h6-7H,1-5H2,(H,10,11) |
InChI Key: | ZZYFPVFTMRZIAE-UHFFFAOYSA-N |
Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.08487243 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.08487243 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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