5-(3-Methoxyphenyl)isoxazole-3-methanamine Hydrochloride - CAS 1263094-48-9
Catalog: |
BB006560 |
Product Name: |
5-(3-Methoxyphenyl)isoxazole-3-methanamine Hydrochloride |
CAS: |
1263094-48-9 |
Synonyms: |
[5-(3-methoxyphenyl)-3-isoxazolyl]methanamine;hydrochloride; [5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methanamine;hydrochloride |
IUPAC Name: | [5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methanamine;hydrochloride |
Description: | 5-(3-Methoxyphenyl)isoxazole-3-methanamine Hydrochloride (CAS# 1263094-48-9) is a useful research chemical. |
Molecular Weight: | 240.69 |
Molecular Formula: | C11H13ClN2O2 |
Canonical SMILES: | COC1=CC=CC(=C1)C2=CC(=NO2)CN.Cl |
InChI: | InChI=1S/C11H12N2O2.ClH/c1-14-10-4-2-3-8(5-10)11-6-9(7-12)13-15-11;/h2-6H,7,12H2,1H3;1H |
InChI Key: | CBYRMYLPRIFYMT-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 201 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.0665554 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.0665554 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 61.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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