Text Search
Structure Search

3-(2-benzylphenoxy)pyrrolidine

3-(2-benzylphenoxy)pyrrolidine

CAS: 946726-75-6

Formula: C17H19NO

SMILES: C(C1=CC=CC=C1)C1=C(OC2CCNC2)C=CC=C1

IUPAC: 3-(2-benzylphenoxy)pyrrolidine

InChI: InChI=1/C17H19NO/c1-2-6-14(7-3-1)12-15-8-4-5-9-17(15)19-16-10-11-18-13-16/h1-9,16,18H,10-13H2

Composition: C (80.60%), H (7.56%), N (5.53%), O (6.32%)

Molar Mass: 253.345

Atom Count: 38

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 253.146664236
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey VHOYBFRUGXGYHH-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.55
Topological Polar Surface Area 21.26
Polarizability 30.58
Ring Count 3
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
MATRIX SCIENTIFIC
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 946726-75-6 $219.25$219.25
Request Quote