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91564-26-0 | 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)ethanol
CAS No: 91564-26-0 Catalog No: AG00690L MDL No:
Product Description
Catalog Number:
AG00690L
Chemical Name:
2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)ethanol
CAS Number:
91564-26-0
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
IUPAC Name:
2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)ethanol
InChI:
InChI=1S/C12H17NO2/c1-15-10-2-3-11-9(8-10)4-6-13-12(11)5-7-14/h2-3,8,12-14H,4-7H2,1H3
InChI Key:
HIHQNABFPBWAQZ-UHFFFAOYSA-N
SMILES:
OCCC1NCCc2c1ccc(c2)OC
NSC Number:
150971
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.273g/mol
Monoisotopic Mass:
207.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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