Name: Name:1,2(1H)-Isoquinolinedicarboxylic acid, 3,4-dihydro-6-hydroxy-,2-(1,1-dimethylethyl) 1-ethyl ester
Brand: Angene
SKU: AG00HRRE
Rating: 90 (10 reviews)

1,2(1H)-Isoquinolinedicarboxylic acid, 3,4-dihydro-6-hydroxy-,2-(1,1-dimethylethyl) 1-ethyl ester

CAS No.:

128073-49-4

Catalog Number:

AG00HRRE

Molecular Formula:

Molecular Weight:

Catalog Number:

AG00HRRE

Chemical Name:

1,2(1H)-Isoquinolinedicarboxylic acid, 3,4-dihydro-6-hydroxy-,2-(1,1-dimethylethyl) 1-ethyl ester

CAS Number:

128073-49-4

MDL Number:

MFCD24466703

IUPAC Name:

2-O-tert-butyl 1-O-ethyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate

InChI:

InChI=1S/C17H23NO5/c1-5-22-15(20)14-13-7-6-12(19)10-11(13)8-9-18(14)16(21)23-17(2,3)4/h6-7,10,14,19H,5,8-9H2,1-4H3

InChI Key:

HOPREPHTFMBXEI-UHFFFAOYSA-N

Complexity:

445

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

321.158g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

321.373g/mol

Monoisotopic Mass:

321.158g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8