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52415-05-1 | 2-Iodo-6-nitro-1,4-xylene
CAS No: 52415-05-1 Catalog No: AG00E2HT MDL No:
Product Description
Catalog Number:
AG00E2HT
Chemical Name:
2-Iodo-6-nitro-1,4-xylene
CAS Number:
52415-05-1
IUPAC Name:
1-iodo-2,5-dimethyl-3-nitrobenzene
InChI:
InChI=1S/C8H8INO2/c1-5-3-7(9)6(2)8(4-5)10(11)12/h3-4H,1-2H3
InChI Key:
MXYQAISPHJYIJL-UHFFFAOYSA-N
Properties
Complexity:
180
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:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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