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Home > Nitro Compounds > 163915-96-6
163915-96-6 | 2-NITROBENZYL METHANESULFONATE
CAS No: 163915-96-6 Catalog No: AG01AQQQ MDL No:MFCD16653092
Product Description
Catalog Number:
AG01AQQQ
Chemical Name:
2-NITROBENZYL METHANESULFONATE
CAS Number:
163915-96-6
MDL Number:
MFCD16653092
IUPAC Name:
(2-nitrophenyl)methyl methanesulfonate
InChI:
InChI=1S/C8H9NO5S/c1-15(12,13)14-6-7-4-2-3-5-8(7)9(10)11/h2-5H,6H2,1H3
InChI Key:
OYWSURWXROADBH-UHFFFAOYSA-N
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.02g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.222g/mol
Monoisotopic Mass:
231.02g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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