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3-(3-phenylpropoxy)pyrrolidine hydrochloride

3-(3-phenylpropoxy)pyrrolidine hydrochloride

CAS: 1185301-70-5

Formula: C13H20ClNO

SMILES: Cl.C(COC1CCNC1)CC1=CC=CC=C1

IUPAC: 3-(3-phenylpropoxy)pyrrolidine hydrochloride

InChI: InChI=1/C13H19NO.ClH/c1-2-5-12(6-3-1)7-4-10-15-13-8-9-14-11-13;/h1-3,5-6,13-14H,4,7-11H2;1H

Composition: C (64.59%), H (8.34%), Cl (14.66%), N (5.79%), O (6.62%)

Molar Mass: 241.76

Atom Count: 36

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 241.123342
Formal Charge 0
FSP3 0.54
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey FYTFMXJNQUVNBR-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.27
Topological Polar Surface Area 21.26
Polarizability 24.65
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1185301-70-5 $344.38-$529.40$344.38$529.40
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