1-Boc-3,3-difluoropiperidine-4-carboxylic Acid - CAS 1303972-81-7
Catalog: |
BB007102 |
Product Name: |
1-Boc-3,3-difluoropiperidine-4-carboxylic Acid |
CAS: |
1303972-81-7 |
Synonyms: |
3,3-difluoro-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinecarboxylic acid; 3,3-difluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid |
IUPAC Name: | 3,3-difluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid |
Description: | 1-Boc-3,3-difluoropiperidine-4-carboxylic Acid (CAS# 1303972-81-7) is a useful research chemical. |
Molecular Weight: | 265.25 |
Molecular Formula: | C11H17F2NO4 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC(C(C1)(F)F)C(=O)O |
InChI: | InChI=1S/C11H17F2NO4/c1-10(2,3)18-9(17)14-5-4-7(8(15)16)11(12,13)6-14/h7H,4-6H2,1-3H3,(H,15,16) |
InChI Key: | HZMYOCGJMSBEDV-UHFFFAOYSA-N |
LogP: | 1.90120 |
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 |
Publication Number | Title | Priority Date |
WO-2020131627-A1 | Substituted pyrazolo[1,5-a]pyridine compounds as inhibitors of fgfr tyrosine kinases | 20181219 |
US-2020123151-A1 | Amino acid compounds with unbranched linkers and methods of use | 20180627 |
CN-112689507-A | Amino acid compounds having unbranched linkers and methods of use thereof | 20180627 |
EP-3813818-A1 | Amino acid compounds with unbranched linkers and methods of use | 20180627 |
BR-112020026278-A2 | AMINO ACIDS COMPOUNDS WITH NON-BRANCHED BINDERS AND METHODS OF USE | 20180627 |
Complexity: | 351 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 265.11256435 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 265.11256435 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.8 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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