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Home > Fluorides > 172617-55-9
172617-55-9 | 2,2,2-Trifluoro-N-[2-(2-iodo-5-methoxyphenyl)ethyl]acetamide
CAS No: 172617-55-9 Catalog No: AG01F6QW MDL No:
Product Description
Catalog Number:
AG01F6QW
Chemical Name:
2,2,2-Trifluoro-N-[2-(2-iodo-5-methoxyphenyl)ethyl]acetamide
CAS Number:
172617-55-9
Molecular Formula:
C11H11F3INO2
Molecular Weight:
373.1102
IUPAC Name:
2,2,2-trifluoro-N-[2-(2-iodo-5-methoxyphenyl)ethyl]acetamide
InChI:
InChI=1S/C11H11F3INO2/c1-18-8-2-3-9(15)7(6-8)4-5-16-10(17)11(12,13)14/h2-3,6H,4-5H2,1H3,(H,16,17)
InChI Key:
VEMUEECVVGWXHA-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)CCNC(=O)C(F)(F)F)I
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.979g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
373.114g/mol
Monoisotopic Mass:
372.979g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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