N-Methyl-(3-methylisoxazol-5-ylmethyl)amine , 97% - CAS 401647-22-1
Catalog: |
BB053539 |
Product Name: |
N-Methyl-(3-methylisoxazol-5-ylmethyl)amine , 97% |
CAS: |
401647-22-1 |
Synonyms: |
N-methyl-(3-methylisoxazol-5-ylmethyl)amine; N-methyl(3-methylisoxazol-5-yl)methanamine |
IUPAC Name: | N-methyl-1-(3-methyl-1,2-oxazol-5-yl)methanamine |
Molecular Weight: | 126.16 |
Molecular Formula: | C6H10N2O |
Canonical SMILES: | CC1=NOC(=C1)CNC |
InChI: | InChI=1S/C6H10N2O/c1-5-3-6(4-7-2)9-8-5/h3,7H,4H2,1-2H3 |
InChI Key: | UQKWKRSUELRKSK-UHFFFAOYSA-N |
Boiling Point: | 197.9±25.0 °C at 760 mmHg |
Purity: | 95% |
Density: | 1.0±0.1 g/cm3 |
Appearance: | Liquid |
Complexity: | 87.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 126.079312947 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 126.079312947 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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