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30933-66-5 | 2-(1H-Indol-4-yl)acetonitrile
CAS No: 30933-66-5 Catalog No: AG0031P3 MDL No:MFCD09263861
Product Description
Catalog Number:
AG0031P3
Chemical Name:
2-(1H-Indol-4-yl)acetonitrile
CAS Number:
30933-66-5
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
MDL Number:
MFCD09263861
IUPAC Name:
2-(1H-indol-4-yl)acetonitrile
InChI:
InChI=1S/C10H8N2/c11-6-4-8-2-1-3-10-9(8)5-7-12-10/h1-3,5,7,12H,4H2
InChI Key:
GRDGWHIQADJRCG-UHFFFAOYSA-N
SMILES:
N#CCc1cccc2c1cc[nH]2
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.069g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
156.188g/mol
Monoisotopic Mass:
156.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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