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(1S)-2-methyl-1-(pyridin-4-yl)propan-1-amine dihydrochloride

(1S)-2-methyl-1-(pyridin-4-yl)propan-1-amine dihydrochloride

CAS: 1391440-45-1

Formula: C9H16Cl2N2

SMILES: Cl.Cl.CC(C)[C@H](N)C1=CC=NC=C1

IUPAC: (1S)-2-methyl-1-(pyridin-4-yl)propan-1-amine dihydrochloride

InChI: InChI=1S/C9H14N2.2ClH/c1-7(2)9(10)8-3-5-11-6-4-8;;/h3-7,9H,10H2,1-2H3;2*1H/t9-;;/m0../s1

Composition: C (48.44%), H (7.23%), Cl (31.77%), N (12.55%)

Molar Mass: 223.14

Atom Count: 29

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 222.0690539
Formal Charge 0
FSP3 0.44
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey VRTAESZQFXXTDZ-WWPIYYJJSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.79
Topological Polar Surface Area 38.91
Polarizability 18.34
Ring Count 1
Rotatable Bond Count 2

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 1391440-45-1 $179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70
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