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20264-96-4 | 1-(2-IODO-ETHYL)-4-NITRO-BENZENE
CAS No: 20264-96-4 Catalog No: AG00BUMX MDL No:
Product Description
Catalog Number:
AG00BUMX
Chemical Name:
1-(2-IODO-ETHYL)-4-NITRO-BENZENE
CAS Number:
20264-96-4
IUPAC Name:
1-(2-iodoethyl)-4-nitrobenzene
InChI:
InChI=1S/C8H8INO2/c9-6-5-7-1-3-8(4-2-7)10(11)12/h1-4H,5-6H2
InChI Key:
SRYFPKKLUIWUGW-UHFFFAOYSA-N
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.96g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.061g/mol
Monoisotopic Mass:
276.96g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Literature
| Title | Journal |
|---|---|
| Synthesis of tetrahydronaphthalene lignan esters by intramolecular cyclization of ethyl p-azidophenyl-2-phenylalkanoates and evaluation of the growth inhibition of human tumor cell lines. | Journal of medicinal chemistry 20110512 |
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