6,7-Dihydro-[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxylic acid tert-butyl ester - CAS 1245782-69-7
Catalog: |
BB042577 |
Product Name: |
6,7-Dihydro-[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxylic acid tert-butyl ester |
CAS: |
1245782-69-7 |
Synonyms: |
tert-Butyl 6,7-dihydro-[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxylate; 5-Boc-4,6,7-trihydro-1,2,3-triazolo[1,5-A]pyrazine; [1,2,3]Triazolo[1,5-a]pyrazine-5(4H)-carboxylic acid, 6,7-dihydro-, 1,1-dimethylethyl ester |
IUPAC Name: | tert-butyl 6,7-dihydro-4H-triazolo[1,5-a]pyrazine-5-carboxylate |
Description: | 6,7-Dihydro-[1,2,3]triazolo[1,5-a]pyrazine-5(4H)-carboxylic acid tert-butyl ester (CAS# 1245782-69-7 ) is a useful research chemical. |
Molecular Weight: | 224.26 |
Molecular Formula: | C10H16N4O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCN2C(=CN=N2)C1 |
InChI: | InChI=1S/C10H16N4O2/c1-10(2,3)16-9(15)13-4-5-14-8(7-13)6-11-12-14/h6H,4-5,7H2,1-3H3 |
InChI Key: | WJRDRGQJIDIENS-UHFFFAOYSA-N |
Complexity: | 277 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 224.12732577 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 224.12732577 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 60.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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