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63905-65-7 | 6,7-DIETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE HYDROCHLORIDE
CAS No: 63905-65-7 Catalog No: AG00ED4R MDL No:MFCD01717445
Product Description
Catalog Number:
AG00ED4R
Chemical Name:
6,7-DIETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE HYDROCHLORIDE
CAS Number:
63905-65-7
Molecular Formula:
C13H20ClNO2
Molecular Weight:
257.7564
MDL Number:
MFCD01717445
IUPAC Name:
6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline;hydrochloride
InChI:
InChI=1S/C13H19NO2.ClH/c1-3-15-12-7-10-5-6-14-9-11(10)8-13(12)16-4-2;/h7-8,14H,3-6,9H2,1-2H3;1H
InChI Key:
GXDZORNOMJIKNT-UHFFFAOYSA-N
SMILES:
CCOc1cc2CNCCc2cc1OCC.Cl
NSC Number:
26634
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.118g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
257.758g/mol
Monoisotopic Mass:
257.118g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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