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2101206-24-8 | methyl 1-benzylpyrrolidine-3-carboxylate oxalate
CAS No: 2101206-24-8 Catalog No: AG01FP61 MDL No:
Product Description
Catalog Number:
AG01FP61
Chemical Name:
methyl 1-benzylpyrrolidine-3-carboxylate oxalate
CAS Number:
2101206-24-8
IUPAC Name:
methyl 1-benzylpyrrolidine-3-carboxylate;oxalic acid
InChI:
InChI=1S/C13H17NO2.C2H2O4/c1-16-13(15)12-7-8-14(10-12)9-11-5-3-2-4-6-11;3-1(4)2(5)6/h2-6,12H,7-10H2,1H3;(H,3,4)(H,5,6)
InChI Key:
URDFHDREHUSQED-UHFFFAOYSA-N
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.121g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
309.318g/mol
Monoisotopic Mass:
309.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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