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10381-08-5 | Indole-3-Acetonitrile
CAS No: 10381-08-5 Catalog No: AG019D46 MDL No:MFCD00005628
Product Description
Catalog Number:
AG019D46
Chemical Name:
Indole-3-Acetonitrile
CAS Number:
10381-08-5
MDL Number:
MFCD00005628
IUPAC Name:
2-(3H-inden-1-yl)acetonitrile
InChI:
InChI=1S/C11H9N/c12-8-7-10-6-5-9-3-1-2-4-11(9)10/h1-4,6H,5,7H2
InChI Key:
XKRYOUCCZJSMIW-UHFFFAOYSA-N
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.073g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.2g/mol
Monoisotopic Mass:
155.073g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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