5-Cyclopentyl-1,3,4-oxadiazol-2-amine - CAS 90221-15-1
Catalog: |
BB039787 |
Product Name: |
5-Cyclopentyl-1,3,4-oxadiazol-2-amine |
CAS: |
90221-15-1 |
Synonyms: |
5-cyclopentyl-1,3,4-oxadiazol-2-amine |
IUPAC Name: | 5-cyclopentyl-1,3,4-oxadiazol-2-amine |
Description: | 5-Cyclopentyl-1,3,4-oxadiazol-2-amine (CAS# 90221-15-1) is a useful research chemical. |
Molecular Weight: | 153.18 |
Molecular Formula: | C7H11N3O |
Canonical SMILES: | C1CCC(C1)C2=NN=C(O2)N |
InChI: | InChI=1S/C7H11N3O/c8-7-10-9-6(11-7)5-3-1-2-4-5/h5H,1-4H2,(H2,8,10) |
InChI Key: | ZMMAKUGJTOHVRG-UHFFFAOYSA-N |
Boiling Point: | 303.1 ℃ at 760 mmHg |
Density: | 1.231 g/cm3 |
MDL: | MFCD09806418 |
LogP: | 1.89060 |
GHS Hazard Statement: | H302 (50%): 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 |
BR-112020012177-A2 | triazole azoles of cyclohexylic acid as lpa antagonists | 20171219 |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.090211983 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.090211983 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 64.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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