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858680-24-7 | 2-iodo-4-phenylaniline
CAS No: 858680-24-7 Catalog No: AG01DWQD MDL No:MFCD24160448
Product Description
Catalog Number:
AG01DWQD
Chemical Name:
2-iodo-4-phenylaniline
CAS Number:
858680-24-7
Molecular Formula:
C12H10IN
Molecular Weight:
295.1190
MDL Number:
MFCD24160448
IUPAC Name:
2-iodo-4-phenylaniline
InChI:
InChI=1S/C12H10IN/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-8H,14H2
InChI Key:
NBGAGEUWEYBRSR-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1I)c1ccccc1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.986g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.123g/mol
Monoisotopic Mass:
294.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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