5-Cyclobutyl-1,3,4-oxadiazol-2-amine - CAS 89464-84-6
Catalog: |
BB039487 |
Product Name: |
5-Cyclobutyl-1,3,4-oxadiazol-2-amine |
CAS: |
89464-84-6 |
Synonyms: |
5-cyclobutyl-1,3,4-oxadiazol-2-amine |
IUPAC Name: | 5-cyclobutyl-1,3,4-oxadiazol-2-amine |
Description: | 5-Cyclobutyl-1,3,4-oxadiazol-2-amine (CAS# 89464-84-6) is a useful research chemical. |
Molecular Weight: | 139.16 |
Molecular Formula: | C6H9N3O |
Canonical SMILES: | C1CC(C1)C2=NN=C(O2)N |
InChI: | InChI=1S/C6H9N3O/c7-6-9-8-5(10-6)4-2-1-3-4/h4H,1-3H2,(H2,7,9) |
InChI Key: | XJOJXINBSJBDHU-UHFFFAOYSA-N |
Boiling Point: | 290.9 °C at 760 mmHg |
Density: | 1.304 g/cm3 |
MDL: | MFCD09815578 |
LogP: | 1.50050 |
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 |
Complexity: | 126 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 139.074561919 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 139.074561919 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 64.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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