Text Search
Structure Search

1-[3-(4-nitrophenoxy)propyl]pyrrolidine

1-[3-(4-nitrophenoxy)propyl]pyrrolidine

CAS: 92033-81-3

Formula: C13H18N2O3

SMILES: [O-][N+](=O)C1=CC=C(OCCCN2CCCC2)C=C1

IUPAC: 1-[3-(4-nitrophenoxy)propyl]pyrrolidine

InChI: InChI=1S/C13H18N2O3/c16-15(17)12-4-6-13(7-5-12)18-11-3-10-14-8-1-2-9-14/h4-7H,1-3,8-11H2

Composition: C (62.38%), H (7.25%), N (11.19%), O (19.18%)

Molar Mass: 250.298

Atom Count: 36

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 250.131742448
Formal Charge 0
FSP3 0.54
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey JQLAYZSNLAOKEW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 69.27
Topological Polar Surface Area 55.61
Polarizability 26.56
Ring Count 2
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 92033-81-3 $76.59$76.59
Request Quote
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 92033-81-3 $147.54$147.54
Request Quote