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54616-46-5 | Benzamide, 2-iodo-N,N-dimethyl-
CAS No: 54616-46-5 Catalog No: AG00I9RF MDL No:MFCD00463660
Product Description
Catalog Number:
AG00I9RF
Chemical Name:
Benzamide, 2-iodo-N,N-dimethyl-
CAS Number:
54616-46-5
Molecular Formula:
C9H10INO
Molecular Weight:
275.0863
MDL Number:
MFCD00463660
IUPAC Name:
2-iodo-N,N-dimethylbenzamide
InChI:
InChI=1S/C9H10INO/c1-11(2)9(12)7-5-3-4-6-8(7)10/h3-6H,1-2H3
InChI Key:
LIJKCLMUVWTDKS-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1ccccc1I)C
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.981g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.089g/mol
Monoisotopic Mass:
274.981g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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