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100347-66-8 | Benzofuro[3,2-c]pyridine-2(1H)-ethanamine, 3,4-dihydro-N,N-dimethyl-, hydrochloride (1:1)
CAS No: 100347-66-8 Catalog No: AG0001OE MDL No:
Product Description
Catalog Number:
AG0001OE
Chemical Name:
Benzofuro[3,2-c]pyridine-2(1H)-ethanamine, 3,4-dihydro-N,N-dimethyl-, hydrochloride (1:1)
CAS Number:
100347-66-8
Molecular Formula:
C15H21ClN2O
Molecular Weight:
280.7930
IUPAC Name:
2-(3,4-dihydro-1H-[1]benzofuro[3,2-c]pyridin-2-yl)-N,N-dimethylethanamine;dihydrochloride
InChI:
InChI=1S/C15H20N2O.2ClH/c1-16(2)9-10-17-8-7-15-13(11-17)12-5-3-4-6-14(12)18-15;;/h3-6H,7-11H2,1-2H3;2*1H
InChI Key:
ODZFRTRBDJLLNH-UHFFFAOYSA-N
SMILES:
CN(CCN1CCc2c(C1)c1ccccc1o2)C.Cl
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.111g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
317.254g/mol
Monoisotopic Mass:
316.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
19.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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