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103658-80-6 | Guanidine,[[4-hydroxy-3-(iodo-125I)phenyl]methyl]- (9CI)
CAS No: 103658-80-6 Catalog No: AG007XA9 MDL No:
Product Description
Catalog Number:
AG007XA9
Chemical Name:
Guanidine,[[4-hydroxy-3-(iodo-125I)phenyl]methyl]- (9CI)
CAS Number:
103658-80-6
Molecular Formula:
C8H10IN3O
Molecular Weight:
291.0890
IUPAC Name:
2-[(4-hydroxy-3-iodophenyl)methyl]guanidine
InChI:
InChI=1S/C8H10IN3O/c9-6-3-5(1-2-7(6)13)4-12-8(10)11/h1-3,13H,4H2,(H4,10,11,12)
InChI Key:
AADOYYQFRWXOOZ-UHFFFAOYSA-N
SMILES:
NC(=N)NCc1ccc(c(c1)I)O
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.987g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
291.092g/mol
Monoisotopic Mass:
290.987g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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