Name: Name:Ethanone, 1-(3,4-dihydro-8-hydroxy-2(1H)-isoquinolinyl)-
Brand: Angene
SKU: AG001CX6
Rating: 90 (10 reviews)

Ethanone, 1-(3,4-dihydro-8-hydroxy-2(1H)-isoquinolinyl)-

CAS No.:

140865-97-0

Catalog Number:

AG001CX6

Molecular Formula:

C11H13NO2

Molecular Weight:

191.2264

Catalog Number:

AG001CX6

Chemical Name:

Ethanone, 1-(3,4-dihydro-8-hydroxy-2(1H)-isoquinolinyl)-

CAS Number:

140865-97-0

Molecular Formula:

C11H13NO2

Molecular Weight:

191.2264

MDL Number:

MFCD11559062

IUPAC Name:

1-(8-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

InChI:

InChI=1S/C11H13NO2/c1-8(13)12-6-5-9-3-2-4-11(14)10(9)7-12/h2-4,14H,5-7H2,1H3

InChI Key:

OJWXEAAIIQCQFH-UHFFFAOYSA-N

SMILES:

CC(=O)N1CCc2c(C1)c(O)ccc2

Complexity:

229

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

191.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

191.23g/mol

Monoisotopic Mass:

191.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9