Name: Name:1-Oxo-1,2,3,4-tetrahydroisoquinoline-7-carbonitrile
Brand: Angene
SKU: AG00HTZ0
Rating: 90 (10 reviews)

1-Oxo-1,2,3,4-tetrahydroisoquinoline-7-carbonitrile

CAS No.:

1352394-88-7

Catalog Number:

AG00HTZ0

Molecular Formula:

C10H8N2O

Molecular Weight:

172.1833

Catalog Number:

AG00HTZ0

Chemical Name:

1-Oxo-1,2,3,4-tetrahydroisoquinoline-7-carbonitrile

CAS Number:

1352394-88-7

Molecular Formula:

C10H8N2O

Molecular Weight:

172.1833

MDL Number:

MFCD20923411

IUPAC Name:

1-oxo-3,4-dihydro-2H-isoquinoline-7-carbonitrile

InChI:

InChI=1S/C10H8N2O/c11-6-7-1-2-8-3-4-12-10(13)9(8)5-7/h1-2,5H,3-4H2,(H,12,13)

InChI Key:

XDOWUVZONFUECH-UHFFFAOYSA-N

SMILES:

N#Cc1ccc2c(c1)C(=O)NCC2

Complexity:

265

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

172.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

172.187g/mol

Monoisotopic Mass:

172.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: