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26391-44-6 | Pyrrolidine, 1-[3-[2-(2-methylphenoxy)phenoxy]propyl]-, hydrochloride (1:1)
CAS No: 26391-44-6 Catalog No: AG002T0M MDL No:
Product Description
Catalog Number:
AG002T0M
Chemical Name:
Pyrrolidine, 1-[3-[2-(2-methylphenoxy)phenoxy]propyl]-, hydrochloride (1:1)
CAS Number:
26391-44-6
Molecular Formula:
C20H26ClNO2
Molecular Weight:
347.8789
IUPAC Name:
1-[3-[2-(2-methylphenoxy)phenoxy]propyl]pyrrolidine;hydrochloride
InChI:
InChI=1S/C20H25NO2.ClH/c1-17-9-2-3-10-18(17)23-20-12-5-4-11-19(20)22-16-8-15-21-13-6-7-14-21;/h2-5,9-12H,6-8,13-16H2,1H3;1H
InChI Key:
YHPIEPHYODNNOB-UHFFFAOYSA-N
SMILES:
Cc1ccccc1Oc1ccccc1OCCCN1CCCC1.Cl
Properties
Complexity:
330
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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