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429689-24-7 | (3S)-()-3-(1-Methyl-1H-indol-3-yl)butanenitrile
CAS No: 429689-24-7 Catalog No: AG003BTC MDL No:
Product Description
Catalog Number:
AG003BTC
Chemical Name:
(3S)-()-3-(1-Methyl-1H-indol-3-yl)butanenitrile
CAS Number:
429689-24-7
IUPAC Name:
(3S)-3-(1-methylindol-3-yl)butanenitrile
InChI:
InChI=1S/C13H14N2/c1-10(7-8-14)12-9-15(2)13-6-4-3-5-11(12)13/h3-6,9-10H,7H2,1-2H3/t10-/m0/s1
InChI Key:
JWGJENJOKQETPV-JTQLQIEISA-N
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
198.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.269g/mol
Monoisotopic Mass:
198.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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