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Home > Indoles and Oxindole > 1396980-54-3
1396980-54-3 | 3-(2-Piperidinyl)-1h-indole oxalate (2:1)
CAS No: 1396980-54-3 Catalog No: AG00HVO8 MDL No:
Product Description
Catalog Number:
AG00HVO8
Chemical Name:
3-(2-Piperidinyl)-1h-indole oxalate (2:1)
CAS Number:
1396980-54-3
IUPAC Name:
oxalic acid;3-piperidin-2-yl-1H-indole
InChI:
InChI=1S/2C13H16N2.C2H2O4/c2*1-2-6-12-10(5-1)11(9-15-12)13-7-3-4-8-14-13;3-1(4)2(5)6/h2*1-2,5-6,9,13-15H,3-4,7-8H2;(H,3,4)(H,5,6)
InChI Key:
GRFMMABNZQGHFG-UHFFFAOYSA-N
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
490.258g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
490.604g/mol
Monoisotopic Mass:
490.258g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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