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41687-30-3 | 2-(3-Nitrophenylsulfonyl)ethanol
CAS No: 41687-30-3 Catalog No: AG003EU8 MDL No:
Product Description
Catalog Number:
AG003EU8
Chemical Name:
2-(3-Nitrophenylsulfonyl)ethanol
CAS Number:
41687-30-3
IUPAC Name:
2-(3-nitrophenyl)sulfonylethanol
InChI:
InChI=1S/C8H9NO5S/c10-4-5-15(13,14)8-3-1-2-7(6-8)9(11)12/h1-3,6,10H,4-5H2
InChI Key:
VMORQDKKMBAQPJ-UHFFFAOYSA-N
EC Number:
255-501-9
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:
1
Isotope Atom Count:
0
Molecular Weight:
231.222g/mol
Monoisotopic Mass:
231.02g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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