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Home > Indoles and Oxindole > 889451-26-7
889451-26-7 | 3-Iodo-4,7-diazaindole
CAS No: 889451-26-7 Catalog No: AG00IFIR MDL No:MFCD19382469
Product Description
Catalog Number:
AG00IFIR
Chemical Name:
3-Iodo-4,7-diazaindole
CAS Number:
889451-26-7
Molecular Formula:
C6H4IN3
Molecular Weight:
245.0205
MDL Number:
MFCD19382469
IUPAC Name:
7-iodo-5H-pyrrolo[2,3-b]pyrazine
InChI:
InChI=1S/C6H4IN3/c7-4-3-10-6-5(4)8-1-2-9-6/h1-3H,(H,9,10)
InChI Key:
YGZUTCSWHPWNMC-UHFFFAOYSA-N
SMILES:
Ic1c[nH]c2c1nccn2
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.945g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.023g/mol
Monoisotopic Mass:
244.945g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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