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68935-26-2 | S-(-)-3-(1-Methyl-2-pyrrolidinyl)pyridiniuM (+)-Di-p-toluoyl Tartrate
CAS No: 68935-26-2 Catalog No: AG00FDUD MDL No:
Product Description
Catalog Number:
AG00FDUD
Chemical Name:
S-(-)-3-(1-Methyl-2-pyrrolidinyl)pyridiniuM (+)-Di-p-toluoyl Tartrate
CAS Number:
68935-26-2
IUPAC Name:
(2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid;3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
InChI:
InChI=1S/C20H18O8.C10H14N2/c1-11-3-7-13(8-4-11)19(25)27-15(17(21)22)16(18(23)24)28-20(26)14-9-5-12(2)6-10-14;1-12-7-3-5-10(12)9-4-2-6-11-8-9/h3-10,15-16H,1-2H3,(H,21,22)(H,23,24);2,4,6,8,10H,3,5,7H2,1H3/t15-,16-;10-/m10/s1
InChI Key:
GEGPCGHEPLKDLY-VZOQACJPSA-N
Properties
Complexity:
680
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
548.216g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
548.592g/mol
Monoisotopic Mass:
548.216g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
143A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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