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98961-41-2 |
CAS No: 98961-41-2 Catalog No: AG01FOK3 MDL No:
Product Description
Catalog Number:
AG01FOK3
CAS Number:
98961-41-2
IUPAC Name:
2-[2-hydroxyethyl-(5-nitropyridin-2-yl)amino]ethanol
InChI:
InChI=1S/C9H13N3O4/c13-5-3-11(4-6-14)9-2-1-8(7-10-9)12(15)16/h1-2,7,13-14H,3-6H2
InChI Key:
YUUZSBYKTCADTD-UHFFFAOYSA-N
NSC Number:
96978
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.091g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
227.22g/mol
Monoisotopic Mass:
227.091g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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