Name: Name:3,3,6-trimethyl-1,2,3,4-tetrahydroisoquinolin-1-one
Brand: Angene
SKU: AG01AMWA
Rating: 90 (10 reviews)

3,3,6-trimethyl-1,2,3,4-tetrahydroisoquinolin-1-one

CAS No.:

1820736-06-8

Catalog Number:

AG01AMWA

Molecular Formula:

C12H15NO

Molecular Weight:

189.2536

Catalog Number:

AG01AMWA

Chemical Name:

3,3,6-trimethyl-1,2,3,4-tetrahydroisoquinolin-1-one

CAS Number:

1820736-06-8

Molecular Formula:

C12H15NO

Molecular Weight:

189.2536

MDL Number:

MFCD29034047

IUPAC Name:

3,3,6-trimethyl-2,4-dihydroisoquinolin-1-one

InChI:

InChI=1S/C12H15NO/c1-8-4-5-10-9(6-8)7-12(2,3)13-11(10)14/h4-6H,7H2,1-3H3,(H,13,14)

InChI Key:

STJRMNJMCGHQFR-UHFFFAOYSA-N

SMILES:

Cc1ccc2c(c1)CC(NC2=O)(C)C

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

189.115g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

189.258g/mol

Monoisotopic Mass:

189.115g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2