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4102-54-9 | 2-Iodo-4,6-dimethylaniline
CAS No: 4102-54-9 Catalog No: AG0073KD MDL No:MFCD07779005
Product Description
Catalog Number:
AG0073KD
Chemical Name:
2-Iodo-4,6-dimethylaniline
CAS Number:
4102-54-9
Molecular Formula:
C8H10IN
Molecular Weight:
247.0762
MDL Number:
MFCD07779005
IUPAC Name:
2-iodo-4,6-dimethylaniline
InChI:
InChI=1S/C8H10IN/c1-5-3-6(2)8(10)7(9)4-5/h3-4H,10H2,1-2H3
InChI Key:
ODPOIEACUVQCBZ-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)I)N
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.986g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.079g/mol
Monoisotopic Mass:
246.986g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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