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Home > Nitro Compounds > 852281-23-3
852281-23-3 | Pyrrolidine, 2-(3-nitrophenyl)-
CAS No: 852281-23-3 Catalog No: AG004V9Z MDL No:
Product Description
Catalog Number:
AG004V9Z
Chemical Name:
Pyrrolidine, 2-(3-nitrophenyl)-
CAS Number:
852281-23-3
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
IUPAC Name:
2-(3-nitrophenyl)pyrrolidine
InChI:
InChI=1S/C10H12N2O2/c13-12(14)9-4-1-3-8(7-9)10-5-2-6-11-10/h1,3-4,7,10-11H,2,5-6H2
InChI Key:
GWKHUTICOQRERL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)C1CCCN1
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.218g/mol
Monoisotopic Mass:
192.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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