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69730-91-2 | (2S)-1-Butyryl-2α-(3-pyridinyl)pyrrolidine
CAS No: 69730-91-2 Catalog No: AG00G1B3 MDL No:
Product Description
Catalog Number:
AG00G1B3
Chemical Name:
(2S)-1-Butyryl-2α-(3-pyridinyl)pyrrolidine
CAS Number:
69730-91-2
IUPAC Name:
1-[(2S)-2-pyridin-3-ylpyrrolidin-1-yl]butan-1-one
InChI:
InChI=1S/C13H18N2O/c1-2-5-13(16)15-9-4-7-12(15)11-6-3-8-14-10-11/h3,6,8,10,12H,2,4-5,7,9H2,1H3/t12-/m0/s1
InChI Key:
MIRXCTXDBCQAAR-LBPRGKRZSA-N
UNII:
V62BKD4JB9
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
218.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.3g/mol
Monoisotopic Mass:
218.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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