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13270-57-0 | Pyridine, 4-methyl-3-[(2S)-1-methyl-2-pyrrolidinyl]-
CAS No: 13270-57-0 Catalog No: AG001116 MDL No:
Product Description
Catalog Number:
AG001116
Chemical Name:
Pyridine, 4-methyl-3-[(2S)-1-methyl-2-pyrrolidinyl]-
CAS Number:
13270-57-0
Molecular Formula:
C11H16N2
Molecular Weight:
176.2581
IUPAC Name:
4-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
InChI:
InChI=1S/C11H16N2/c1-9-5-6-12-8-10(9)11-4-3-7-13(11)2/h5-6,8,11H,3-4,7H2,1-2H3/t11-/m0/s1
InChI Key:
COIKDFOCBSAINO-NSHDSACASA-N
SMILES:
CN1CCC[C@H]1c1cnccc1C
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
176.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.263g/mol
Monoisotopic Mass:
176.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
16.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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