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Home > Indoles and Oxindole > 674303-99-2
674303-99-2 | 3-Hexanone, 5-(1H-indol-3-yl)-
CAS No: 674303-99-2 Catalog No: AG0061Y5 MDL No:
Product Description
Catalog Number:
AG0061Y5
Chemical Name:
3-Hexanone, 5-(1H-indol-3-yl)-
CAS Number:
674303-99-2
Molecular Formula:
C14H17NO
Molecular Weight:
215.2909
IUPAC Name:
5-(1H-indol-3-yl)hexan-3-one
InChI:
InChI=1S/C14H17NO/c1-3-11(16)8-10(2)13-9-15-14-7-5-4-6-12(13)14/h4-7,9-10,15H,3,8H2,1-2H3
InChI Key:
WFMDVHHEHLNWTL-UHFFFAOYSA-N
SMILES:
CCC(=O)CC(c1c[nH]c2c1cccc2)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.131g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.296g/mol
Monoisotopic Mass:
215.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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