Tert-butyl 1,5-naphthyridin-3-ylcarbamate - CAS 959617-73-3
Catalog: |
BB044324 |
Product Name: |
Tert-butyl 1,5-naphthyridin-3-ylcarbamate |
CAS: |
959617-73-3 |
Synonyms: |
Carbamic acid, N-1,5-naphthyridin-3-yl-, 1,1-dimethylethyl ester; 2-Methyl-2-propanyl 1,5-naphthyridin-3-ylcarbamate |
IUPAC Name: | tert-butyl N-(1,5-naphthyridin-3-yl)carbamate |
Description: | Tert-butyl 1,5-naphthyridin-3-ylcarbamate (CAS# 959617-73-3 ) is a useful research chemical. |
Molecular Weight: | 245.28 |
Molecular Formula: | C13H15N3O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=CC2=C(C=CC=N2)N=C1 |
InChI: | InChI=1S/C13H15N3O2/c1-13(2,3)18-12(17)16-9-7-11-10(15-8-9)5-4-6-14-11/h4-8H,1-3H3,(H,16,17) |
InChI Key: | GSTMUJGINQFVNK-UHFFFAOYSA-N |
Boiling Point: | 350.1±22.0 ℃ at 760 mmHg |
Purity: | ≥ 97 % |
Density: | 1.232±0.06 g/cm3 at 20 ℃, 760 mmH g |
Complexity: | 301 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 245.11642673 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 245.11642673 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 64.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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