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139193-89-8 | Morpholine, 4-[2-[2-[2-(3-methyl-5-isoxazolyl)ethenyl]phenoxy]ethyl]-, monohydrochloride, (E)- (9CI)
CAS No: 139193-89-8 Catalog No: AG001AHF MDL No:
Product Description
Catalog Number:
AG001AHF
Chemical Name:
Morpholine, 4-[2-[2-[2-(3-methyl-5-isoxazolyl)ethenyl]phenoxy]ethyl]-, monohydrochloride, (E)- (9CI)
CAS Number:
139193-89-8
Molecular Formula:
C18H23ClN2O3
Molecular Weight:
350.8398
IUPAC Name:
4-[2-[2-[2-(3-methyl-2H-1,3-oxazol-5-yl)ethenyl]phenoxy]ethyl]morpholine;hydrochloride
InChI:
InChI=1S/C18H24N2O3.ClH/c1-19-14-17(23-15-19)7-6-16-4-2-3-5-18(16)22-13-10-20-8-11-21-12-9-20;/h2-7,14H,8-13,15H2,1H3;1H
InChI Key:
OOZNMOOVPYUCJJ-UHFFFAOYSA-N
SMILES:
Cc1noc(c1)/C=C/c1ccccc1OCCN1CCOCC1.Cl
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.155g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
352.859g/mol
Monoisotopic Mass:
352.155g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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