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Home > Nitro Compounds > 882257-23-0
882257-23-0 | 1-[2-(methylsulfanyl)-5-nitrophenyl]ethan-1-one
CAS No: 882257-23-0 Catalog No: AG01BTN7 MDL No:MFCD01566453
Product Description
Catalog Number:
AG01BTN7
Chemical Name:
1-[2-(methylsulfanyl)-5-nitrophenyl]ethan-1-one
CAS Number:
882257-23-0
MDL Number:
MFCD01566453
IUPAC Name:
1-(2-methylsulfanyl-5-nitrophenyl)ethanone
InChI:
InChI=1S/C9H9NO3S/c1-6(11)8-5-7(10(12)13)3-4-9(8)14-2/h3-5H,1-2H3
InChI Key:
JUSPIIZYFLLBBK-UHFFFAOYSA-N
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.03g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.235g/mol
Monoisotopic Mass:
211.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
88.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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