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23026-52-0 | 1-Pyrrolidinepropanol, 3-(2-methoxyphenoxy)-, 1-benzoate, ethanedioate (1:1)
CAS No: 23026-52-0 Catalog No: AG002LX4 MDL No:
Product Description
Catalog Number:
AG002LX4
Chemical Name:
1-Pyrrolidinepropanol, 3-(2-methoxyphenoxy)-, 1-benzoate, ethanedioate (1:1)
CAS Number:
23026-52-0
IUPAC Name:
3-[3-(2-methoxyphenoxy)pyrrolidin-1-yl]propyl benzoate;oxalic acid
InChI:
InChI=1S/C21H25NO4.C2H2O4/c1-24-19-10-5-6-11-20(19)26-18-12-14-22(16-18)13-7-15-25-21(23)17-8-3-2-4-9-17;3-1(4)2(5)6/h2-6,8-11,18H,7,12-16H2,1H3;(H,3,4)(H,5,6)
InChI Key:
RWXUAXZBVQALCH-UHFFFAOYSA-N
Properties
Complexity:
496
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
445.174g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
445.468g/mol
Monoisotopic Mass:
445.174g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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