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Home > Indoles and Oxindole > 1305711-30-1
1305711-30-1 | 3-iodo-1H-indole-5-carboxamide
CAS No: 1305711-30-1 Catalog No: AG019ROY MDL No:MFCD18089661
Product Description
Catalog Number:
AG019ROY
Chemical Name:
3-iodo-1H-indole-5-carboxamide
CAS Number:
1305711-30-1
Molecular Formula:
C9H7IN2O
Molecular Weight:
286.0691
MDL Number:
MFCD18089661
IUPAC Name:
3-iodo-1H-indole-5-carboxamide
InChI:
InChI=1S/C9H7IN2O/c10-7-4-12-8-2-1-5(9(11)13)3-6(7)8/h1-4,12H,(H2,11,13)
InChI Key:
ZDVFWYDPVRWLAZ-UHFFFAOYSA-N
SMILES:
NC(=O)c1cc2c(I)c[nH]c2cc1
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.96g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.072g/mol
Monoisotopic Mass:
285.96g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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