3-Cyclopropylisoxazol-5-amine - CAS 21080-91-1
Catalog: |
BB049041 |
Product Name: |
3-Cyclopropylisoxazol-5-amine |
CAS: |
21080-91-1 |
Synonyms: |
5-Isoxazolamine, 3-cyclopropyl-; 3-cyclopropylisoxazole-5-ylamine; (3-cyclopropylisoxazol-5-yl)amine; 3-cyclopropyl-5-isoxazolamine |
IUPAC Name: | 3-cyclopropyl-1,2-oxazol-5-amine |
Description: | 3-Cyclopropylisoxazol-5-amine (CAS# 21080-91-1 ) is a useful research chemical. |
Molecular Weight: | 124.14 |
Molecular Formula: | C6H8N2O |
Canonical SMILES: | C1CC1C2=NOC(=C2)N |
InChI: | InChI=1S/C6H8N2O/c7-6-3-5(8-9-6)4-1-2-4/h3-4H,1-2,7H2 |
InChI Key: | HAFQCGUIQVGCKG-UHFFFAOYSA-N |
Boiling Point: | 294.5±28.0 ℃ (Predicted) |
Purity: | 97 % |
Density: | 1.296±0.06 g/cm3 (Predicted) |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 114 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 124.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 124.063662883 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 52 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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Amines and Anilines
Isoxazoles
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