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1017125-75-5 | 7-ethyl-1,2,3,4-tetrahydroisoquinoline
CAS No: 1017125-75-5 Catalog No: AG01AJJY MDL No:MFCD09886721
Product Description
Catalog Number:
AG01AJJY
Chemical Name:
7-ethyl-1,2,3,4-tetrahydroisoquinoline
CAS Number:
1017125-75-5
Molecular Formula:
C11H15N
Molecular Weight:
161.2435
MDL Number:
MFCD09886721
IUPAC Name:
7-ethyl-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C11H15N/c1-2-9-3-4-10-5-6-12-8-11(10)7-9/h3-4,7,12H,2,5-6,8H2,1H3
InChI Key:
LWBFOGGRLDRNOH-UHFFFAOYSA-N
SMILES:
CCc1ccc2c(c1)CNCC2
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:
2.4
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