3-(Boc-amino)pyridine - CAS 56700-70-0
Catalog: |
BB029468 |
Product Name: |
3-(Boc-amino)pyridine |
CAS: |
56700-70-0 |
Synonyms: |
tert-butyl N-pyridin-3-ylcarbamate |
IUPAC Name: | tert-butyl N-pyridin-3-ylcarbamate |
Description: | 3-(Boc-amino)pyridine (CAS# 56700-70-0) is a useful research chemical. |
Molecular Weight: | 194.23 |
Molecular Formula: | C10H14N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=CN=CC=C1 |
InChI: | InChI=1S/C10H14N2O2/c1-10(2,3)14-9(13)12-8-5-4-6-11-7-8/h4-7H,1-3H3,(H,12,13) |
InChI Key: | WKHGDPZRLXDVMJ-UHFFFAOYSA-N |
Boiling Point: | 252.743 ℃ at 760 mmHg |
Density: | 1.131 g/cm3 |
MDL: | MFCD02179231 |
LogP: | 2.50160 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021016333-A1 | Aryl sulfonamides as small molecule stat3 inhibitors | 20190722 |
US-2020190045-A1 | Ferroportin inhibitors and methods of use | 20181213 |
WO-2020123850-A1 | Ferroportin inhibitors and methods of use | 20181213 |
EP-3894416-A1 | Ferroportin inhibitors and methods of use | 20181213 |
US-2020216410-A1 | Modulators of p97 aaa atpase activity | 20170511 |
Complexity: | 199 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.105527694 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.105527694 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 51.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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Pyridines
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