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Home > Nitro Compounds > 1286208-84-1
1286208-84-1 | (R)-3-(4-Nitrophenoxy)pyrrolidine hydrochloride
CAS No: 1286208-84-1 Catalog No: AG01ERRW MDL No:
Product Description
Catalog Number:
AG01ERRW
Chemical Name:
(R)-3-(4-Nitrophenoxy)pyrrolidine hydrochloride
CAS Number:
1286208-84-1
Molecular Formula:
C10H13ClN2O3
Molecular Weight:
244.6748
IUPAC Name:
(3R)-3-(4-nitrophenoxy)pyrrolidine;hydrochloride
InChI:
InChI=1S/C10H12N2O3.ClH/c13-12(14)8-1-3-9(4-2-8)15-10-5-6-11-7-10;/h1-4,10-11H,5-7H2;1H/t10-;/m1./s1
InChI Key:
KMTLAWJEKPIRFL-HNCPQSOCSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)O[C@H]1CNCC1.Cl
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
244.061g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
244.675g/mol
Monoisotopic Mass:
244.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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