Name: Name:1,3,4,5-TETRAHYDRO-7-METHOXY-2H-1-BENZAZEPIN-2-ONE
Brand: Angene
SKU: AG00C3E1
Rating: 90 (10 reviews)

1,3,4,5-TETRAHYDRO-7-METHOXY-2H-1-BENZAZEPIN-2-ONE

CAS No.:

22245-89-2

Catalog Number:

AG00C3E1

Molecular Formula:

C11H13NO2

Molecular Weight:

191.2264

Catalog Number:

AG00C3E1

Chemical Name:

1,3,4,5-TETRAHYDRO-7-METHOXY-2H-1-BENZAZEPIN-2-ONE

CAS Number:

22245-89-2

Molecular Formula:

C11H13NO2

Molecular Weight:

191.2264

MDL Number:

MFCD00667623

IUPAC Name:

7-methoxy-1,3,4,5-tetrahydro-1-benzazepin-2-one

InChI:

InChI=1S/C11H13NO2/c1-14-9-5-6-10-8(7-9)3-2-4-11(13)12-10/h5-7H,2-4H2,1H3,(H,12,13)

InChI Key:

GZRSCYDBGFKKHY-UHFFFAOYSA-N

SMILES:

COc1ccc2c(c1)CCCC(=O)N2

Complexity:

217

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:

38.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4