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3-chloro-2-(pyrrolidin-1-yl)aniline

3-chloro-2-(pyrrolidin-1-yl)aniline

CAS: 58785-05-0

Formula: C10H13ClN2

SMILES: NC1=C(N2CCCC2)C(Cl)=CC=C1

IUPAC: 3-chloro-2-(pyrrolidin-1-yl)aniline

InChI: InChI=1S/C10H13ClN2/c11-8-4-3-5-9(12)10(8)13-6-1-2-7-13/h3-5H,1-2,6-7,12H2

Composition: C (61.07%), H (6.66%), Cl (18.02%), N (14.24%)

Molar Mass: 196.68

Atom Count: 26

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 196.0767261
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey AURSQVBYAKAFDC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.53
Topological Polar Surface Area 29.26
Polarizability 21.11
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 58785-05-0 $320.85-$494.11$320.85$494.11
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