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887578-31-6 | 1H-Indole-4-carboximidamide
CAS No: 887578-31-6 Catalog No: AG004CGB MDL No:
Product Description
Catalog Number:
AG004CGB
Chemical Name:
1H-Indole-4-carboximidamide
CAS Number:
887578-31-6
Molecular Formula:
C9H9N3
Molecular Weight:
159.1879
IUPAC Name:
1H-indole-4-carboximidamide
InChI:
InChI=1S/C9H9N3/c10-9(11)7-2-1-3-8-6(7)4-5-12-8/h1-5,12H,(H3,10,11)
InChI Key:
DUPGWNUHZFFMBT-UHFFFAOYSA-N
SMILES:
NC(=N)c1cccc2c1cc[nH]2
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.08g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
159.192g/mol
Monoisotopic Mass:
159.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
65.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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