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553629-02-0 | 2-(4-formyl-2-iodo-6-methoxyphenoxy)-N-(2-methylphenyl)acetamide
CAS No: 553629-02-0 Catalog No: AG00JF2I MDL No:MFCD07434246
Product Description
Catalog Number:
AG00JF2I
Chemical Name:
2-(4-formyl-2-iodo-6-methoxyphenoxy)-N-(2-methylphenyl)acetamide
CAS Number:
553629-02-0
Molecular Formula:
C17H16INO4
Molecular Weight:
425.2177
MDL Number:
MFCD07434246
IUPAC Name:
2-(4-formyl-2-iodo-6-methoxyphenoxy)-N-(2-methylphenyl)acetamide
InChI:
InChI=1S/C17H16INO4/c1-11-5-3-4-6-14(11)19-16(21)10-23-17-13(18)7-12(9-20)8-15(17)22-2/h3-9H,10H2,1-2H3,(H,19,21)
InChI Key:
BRXOUJDWOVZUJW-UHFFFAOYSA-N
SMILES:
O=Cc1cc(I)c(c(c1)OC)OCC(=O)Nc1ccccc1C
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
425.012g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
425.222g/mol
Monoisotopic Mass:
425.012g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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