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3-(phenoxymethyl)pyrrolidine hydrochloride

3-(phenoxymethyl)pyrrolidine hydrochloride

CAS: 1185299-28-8

Formula: C11H16ClNO

SMILES: Cl.C(OC1=CC=CC=C1)C1CCNC1

IUPAC: 3-(phenoxymethyl)pyrrolidine hydrochloride

InChI: InChI=1/C11H15NO.ClH/c1-2-4-11(5-3-1)13-9-10-6-7-12-8-10;/h1-5,10,12H,6-9H2;1H

Composition: C (61.82%), H (7.55%), Cl (16.59%), N (6.55%), O (7.49%)

Molar Mass: 213.71

Atom Count: 30

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 213.0920418
Formal Charge 0
FSP3 0.45
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey KLFBGGKKHILQKB-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.8
Topological Polar Surface Area 21.26
Polarizability 21.03
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1185299-28-8 $219.25-$336.89$219.25$336.89
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