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(1r,4r)-N1-ethylcyclohexane-1,4-diamine dihydrochloride

(1r,4r)-N1-ethylcyclohexane-1,4-diamine dihydrochloride

CAS: 1286274-98-3

Formula: C8H20Cl2N2

SMILES: Cl.Cl.CCN[C@H]1CC[C@H](N)CC1

IUPAC: (1r,4r)-N1-ethylcyclohexane-1,4-diamine dihydrochloride

InChI: InChI=1/C8H18N2.2ClH/c1-2-10-8-5-3-7(9)4-6-8;;/h7-8,10H,2-6,9H2,1H3;2*1H/t7-,8-;;

Composition: C (44.66%), H (9.37%), Cl (32.95%), N (13.02%)

Molar Mass: 215.16

Atom Count: 32

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 214.1003541
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey QSUYNPRINPEWPR-WYSYYCCVNA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.78
Topological Polar Surface Area 38.05
Polarizability 17.81
Ring Count 1
Rotatable Bond Count 2

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1286274-98-3 $485.07-$734.16$485.07$485.07$734.16$734.16
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