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[2-(5-methoxy-1H-1,3-benzodiazol-2-yl)ethyl](methyl)amine dihydrochloride

[2-(5-methoxy-1H-1,3-benzodiazol-2-yl)ethyl](methyl)amine dihydrochloride

CAS: 1269393-89-6

Formula: C11H17Cl2N3O

SMILES: Cl.Cl.CNCCC1=NC2=CC(OC)=CC=C2N1

IUPAC: [2-(5-methoxy-1H-1,3-benzodiazol-2-yl)ethyl](methyl)amine dihydrochloride

InChI: InChI=1S/C11H15N3O.2ClH/c1-12-6-5-11-13-9-4-3-8(15-2)7-10(9)14-11;;/h3-4,7,12H,5-6H2,1-2H3,(H,13,14);2*1H

Composition: C (47.50%), H (6.16%), Cl (25.49%), N (15.11%), O (5.75%)

Molar Mass: 278.18

Atom Count: 34

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 277.0748676
Formal Charge 0
FSP3 0.36
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey IWSUMQNLRXKMCN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.71
Topological Polar Surface Area 49.94
Polarizability 24.15
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 1269393-89-6 $28.75-$708.40$28.75$93.15$186.30$708.40
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