1-Boc-3-fluoropiperidine-4-carboxylic Acid - CAS 1303974-46-0
Catalog: |
BB007104 |
Product Name: |
1-Boc-3-fluoropiperidine-4-carboxylic Acid |
CAS: |
1303974-46-0 |
Synonyms: |
3-fluoro-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinecarboxylic acid; 3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid |
IUPAC Name: | 3-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid |
Description: | 1-Boc-3-fluoropiperidine-4-carboxylic Acid (CAS# 1303974-46-0 ) is a useful research chemical. |
Molecular Weight: | 247.26 |
Molecular Formula: | C11H18FNO4 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC(C(C1)F)C(=O)O |
InChI: | InChI=1S/C11H18FNO4/c1-11(2,3)17-10(16)13-5-4-7(9(14)15)8(12)6-13/h7-8H,4-6H2,1-3H3,(H,14,15) |
InChI Key: | VAXFBQGBIHPZCF-UHFFFAOYSA-N |
LogP: | 1.60400 |
Publication Number | Title | Priority Date |
CN-110922354-A | Chemical resolution preparation method of 1-R-3-fluoropiperidine-4-carboxylic acid and product thereof | 20191212 |
CN-112513043-A | Broad spectrum carbapenems | 20180530 |
EP-3802538-A1 | Broad-spectrum carbapenems | 20180530 |
US-2021188851-A1 | Broad-spectrum carbapenems | 20180530 |
EP-3732176-A1 | Heterocyclic amides as kinase inhibitors | 20171229 |
Complexity: | 313 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 247.12198622 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 247.12198622 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.8 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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