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82199-98-2 | 2-(1H-Indol-7-yl)acetonitrile
CAS No: 82199-98-2 Catalog No: AG005HW6 MDL No:MFCD09263867
Product Description
Catalog Number:
AG005HW6
Chemical Name:
2-(1H-Indol-7-yl)acetonitrile
CAS Number:
82199-98-2
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
MDL Number:
MFCD09263867
IUPAC Name:
2-(1H-indol-7-yl)acetonitrile
InChI:
InChI=1S/C10H8N2/c11-6-4-8-2-1-3-9-5-7-12-10(8)9/h1-3,5,7,12H,4H2
InChI Key:
DKFCVYPZODIIMM-UHFFFAOYSA-N
SMILES:
N#CCc1cccc2c1[nH]cc2
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:
1.9
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