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113800-18-3 | Morpholine, 4-[3-[2-(phenoxymethyl)phenyl]propyl]-, hydrochloride (1:1)
CAS No: 113800-18-3 Catalog No: AG0009Q6 MDL No:
Product Description
Catalog Number:
AG0009Q6
Chemical Name:
Morpholine, 4-[3-[2-(phenoxymethyl)phenyl]propyl]-, hydrochloride (1:1)
CAS Number:
113800-18-3
Molecular Formula:
C20H26ClNO2
Molecular Weight:
347.8789
IUPAC Name:
4-[3-[2-(phenoxymethyl)phenyl]propyl]morpholine;hydrochloride
InChI:
InChI=1S/C20H25NO2.ClH/c1-2-10-20(11-3-1)23-17-19-8-5-4-7-18(19)9-6-12-21-13-15-22-16-14-21;/h1-5,7-8,10-11H,6,9,12-17H2;1H
InChI Key:
NFAPTPYTQBHXAC-UHFFFAOYSA-N
SMILES:
O1CCN(CC1)CCCc1ccccc1COc1ccccc1.Cl
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.165g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
347.883g/mol
Monoisotopic Mass:
347.165g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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