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556104-21-3 | 6,7-Isoquinolinediol, 2-ethyl-1,2,3,4-tetrahydro-1,1-dimethyl- (9CI)
CAS No: 556104-21-3 Catalog No: AG00DZ80 MDL No:
Product Description
Catalog Number:
AG00DZ80
Chemical Name:
6,7-Isoquinolinediol, 2-ethyl-1,2,3,4-tetrahydro-1,1-dimethyl- (9CI)
CAS Number:
556104-21-3
IUPAC Name:
2-ethyl-1,1-dimethyl-3,4-dihydroisoquinoline-6,7-diol
InChI:
InChI=1S/C13H19NO2/c1-4-14-6-5-9-7-11(15)12(16)8-10(9)13(14,2)3/h7-8,15-16H,4-6H2,1-3H3
InChI Key:
PEZHTRGMGFXRCH-UHFFFAOYSA-N
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.3g/mol
Monoisotopic Mass:
221.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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