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Home > Aldehydes > 1261849-88-0
1261849-88-0 | Benzaldehyde, 2-amino-3-iodo-
CAS No: 1261849-88-0 Catalog No: AG000S1K MDL No:
Product Description
Catalog Number:
AG000S1K
Chemical Name:
Benzaldehyde, 2-amino-3-iodo-
CAS Number:
1261849-88-0
Molecular Formula:
C7H6INO
Molecular Weight:
247.0331
IUPAC Name:
2-amino-3-iodobenzaldehyde
InChI:
InChI=1S/C7H6INO/c8-6-3-1-2-5(4-10)7(6)9/h1-4H,9H2
InChI Key:
BEFNAVNUQWCRAU-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1N)I
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.949g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.035g/mol
Monoisotopic Mass:
246.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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