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Home > Nitro Compounds > 68743-66-8
68743-66-8 | 2-Pyrrolidinol, 1-nitroso-2-(3-pyridinyl)-
CAS No: 68743-66-8 Catalog No: AG005O9H MDL No:
Product Description
Catalog Number:
AG005O9H
Chemical Name:
2-Pyrrolidinol, 1-nitroso-2-(3-pyridinyl)-
CAS Number:
68743-66-8
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
IUPAC Name:
1-nitroso-2-pyridin-3-ylpyrrolidin-2-ol
InChI:
InChI=1S/C9H11N3O2/c13-9(4-2-6-12(9)11-14)8-3-1-5-10-7-8/h1,3,5,7,13H,2,4,6H2
InChI Key:
XSFLWWFLOHDYKM-UHFFFAOYSA-N
SMILES:
O=NN1CCCC1(O)c1cccnc1
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.206g/mol
Monoisotopic Mass:
193.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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