(5-Methyl-3-phenyl-4-isoxazolyl)methylamine

Base Information

• Chemical Name: (5-Methyl-3-phenyl-4-isoxazolyl)methylamine
• CAS No.: 306935-01-3
• Molecular Formula: C₁₁H₁₂N₂O
• Molecular Weight: 188.229
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID20379846
• Nikkaji Number: J2.243.440C
• Wikidata: Q82169857
• Mol file: 306935-01-3.mol

Synonyms:306935-01-3;(5-METHYL-3-PHENYL-4-ISOXAZOLYL)METHYLAMINE;(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanamine;(5-Methyl-3-phenylisoxazol-4-yl)methanamine;SDCCGMLS-0065905.P001;(5-methyl-3-phenylisoxazol-4-yl)methylamine;SCHEMBL286436;DTXSID20379846;KJGJWCJXSLAKKS-UHFFFAOYSA-N;MFCD02677687;AKOS006228240;PS-4242;2-(Thiophen-2-ylsulfanyl)-succinic acid;3-Phenyl-5-methylisoxazole-4-methaneamine;FT-0604827;[(5-methyl-3-phenylisoxazol-4-yl)methyl]amine;1-(5-Methyl-3-phenyl-1,2-oxazol-4-yl)methanamine;J-501601;(5-methyl-3-phenyl-4-isoxazolyl)methylamine, AldrichCPR

Chemical Property of (5-Methyl-3-phenyl-4-isoxazolyl)methylamine

Chemical Property:

• Vapor Pressure: 1.8E-05mmHg at 25°C
• Melting Point: 66-68°C
• Boiling Point: 363.4°Cat760mmHg
• Flash Point: 173.6°C
• PSA: 52.05000
• Density: 1.127g/cm³
• LogP: 2.80900
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 188.094963011
• Heavy Atom Count: 14
• Complexity: 180

Purity/Quality:

98%min ^*data from raw suppliers

(5-Methyl-3-phenyl-4-isoxazolyl)methylamine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,Xn
• Statements: 34-41-37/38-22
• Safety Statements: 26-36/37/39-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)CN