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Home > Nitro Compounds > 181959-79-5
181959-79-5 | (3R)-1-(4-nitrophenyl)pyrrolidin-3-ol
CAS No: 181959-79-5 Catalog No: AG01AFQB MDL No:MFCD11037809
Product Description
Catalog Number:
AG01AFQB
Chemical Name:
(3R)-1-(4-nitrophenyl)pyrrolidin-3-ol
CAS Number:
181959-79-5
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
MDL Number:
MFCD11037809
IUPAC Name:
1-(4-nitrophenyl)pyrrolidin-3-ol
InChI:
InChI=1S/C10H12N2O3/c13-10-5-6-11(7-10)8-1-3-9(4-2-8)12(14)15/h1-4,10,13H,5-7H2
InChI Key:
KWMXJSMRNOVCDS-UHFFFAOYSA-N
SMILES:
O[C@@H]1CCN(C1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.217g/mol
Monoisotopic Mass:
208.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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