Home Nitriles 4-Amino-1H-indole-6-carbonitrile

4-Amino-1H-indole-6-carbonitrile

CAS No.:
885518-39-8
Catalog Number:
AG004DBX
Molecular Formula:
C9H7N3
Molecular Weight:
157.1720
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Product Description
Catalog Number:
AG004DBX
Chemical Name:
4-Amino-1H-indole-6-carbonitrile
CAS Number:
885518-39-8
Molecular Formula:
C9H7N3
Molecular Weight:
157.1720
MDL Number:
MFCD07357293
IUPAC Name:
4-amino-1H-indole-6-carbonitrile
InChI:
InChI=1S/C9H7N3/c10-5-6-3-8(11)7-1-2-12-9(7)4-6/h1-4,12H,11H2
InChI Key:
ALWCMYAKSPSBAN-UHFFFAOYSA-N
SMILES:
N#Cc1cc(N)c2c(c1)[nH]cc2
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.064g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
157.176g/mol
Monoisotopic Mass:
157.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties