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71711-31-4 | Methyl (3S)-(+)-3-(1-methylindol-3-yl)butanoate
CAS No: 71711-31-4 Catalog No: AG003RIJ MDL No:
Product Description
Catalog Number:
AG003RIJ
Chemical Name:
Methyl (3S)-(+)-3-(1-methylindol-3-yl)butanoate
CAS Number:
71711-31-4
IUPAC Name:
methyl (3S)-3-(1-methylindol-3-yl)butanoate
InChI:
InChI=1S/C14H17NO2/c1-10(8-14(16)17-3)12-9-15(2)13-7-5-4-6-11(12)13/h4-7,9-10H,8H2,1-3H3/t10-/m0/s1
InChI Key:
QIOUBQLAFUPETC-JTQLQIEISA-N
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
231.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.295g/mol
Monoisotopic Mass:
231.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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