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579518-98-2 | 2-(4-formyl-2-iodo-6-methoxyphenoxy)-N-phenylacetamide
CAS No: 579518-98-2 Catalog No: AG00JKDT MDL No:MFCD02257287
Product Description
Catalog Number:
AG00JKDT
Chemical Name:
2-(4-formyl-2-iodo-6-methoxyphenoxy)-N-phenylacetamide
CAS Number:
579518-98-2
Molecular Formula:
C16H14INO4
Molecular Weight:
411.1911
MDL Number:
MFCD02257287
IUPAC Name:
2-(4-formyl-2-iodo-6-methoxyphenoxy)-N-phenylacetamide
InChI:
InChI=1S/C16H14INO4/c1-21-14-8-11(9-19)7-13(17)16(14)22-10-15(20)18-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,20)
InChI Key:
RLSWXEOVBXMHJK-UHFFFAOYSA-N
SMILES:
O=Cc1cc(I)c(c(c1)OC)OCC(=O)Nc1ccccc1
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
410.997g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
411.195g/mol
Monoisotopic Mass:
410.997g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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