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1247353-64-5 | 5-ETHYL-1,2,3,4-TETRAHYDROISOQUINOLINE
CAS No: 1247353-64-5 Catalog No: AG01DYKB MDL No:MFCD16746395
Product Description
Catalog Number:
AG01DYKB
Chemical Name:
5-ETHYL-1,2,3,4-TETRAHYDROISOQUINOLINE
CAS Number:
1247353-64-5
Molecular Formula:
C11H15N
Molecular Weight:
161.2435
MDL Number:
MFCD16746395
IUPAC Name:
5-ethyl-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C11H15N/c1-2-9-4-3-5-10-8-12-7-6-11(9)10/h3-5,12H,2,6-8H2,1H3
InChI Key:
BIUMAWDGXWJADT-UHFFFAOYSA-N
SMILES:
CCc1cccc2c1CCNC2
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.248g/mol
Monoisotopic Mass:
161.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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