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41173-70-0 | 1-Ethyl-3,4-dihydroisoquinoline
CAS No: 41173-70-0 Catalog No: AG01FOX2 MDL No:
Product Description
Catalog Number:
AG01FOX2
Chemical Name:
1-Ethyl-3,4-dihydroisoquinoline
CAS Number:
41173-70-0
IUPAC Name:
1-ethyl-3,4-dihydroisoquinoline
InChI:
InChI=1S/C11H13N/c1-2-11-10-6-4-3-5-9(10)7-8-12-11/h3-6H,2,7-8H2,1H3
InChI Key:
VCOBPTBHSCXEHW-UHFFFAOYSA-N
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.105g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.232g/mol
Monoisotopic Mass:
159.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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