Name: Name:2,2-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepine
Brand: Angene
SKU: AG01BBOC
Rating: 90 (10 reviews)

2,2-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

CAS No.:

1519603-53-2

Catalog Number:

AG01BBOC

Molecular Formula:

C11H15NO

Molecular Weight:

177.2429

Catalog Number:

AG01BBOC

Chemical Name:

2,2-dimethyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

CAS Number:

1519603-53-2

Molecular Formula:

C11H15NO

Molecular Weight:

177.2429

MDL Number:

MFCD26673252

IUPAC Name:

2,2-dimethyl-4,5-dihydro-3H-1,4-benzoxazepine

InChI:

InChI=1S/C11H15NO/c1-11(2)8-12-7-9-5-3-4-6-10(9)13-11/h3-6,12H,7-8H2,1-2H3

InChI Key:

IAWAJAWAYZMKNF-UHFFFAOYSA-N

SMILES:

CC1(C)CNCc2c(O1)cccc2

Complexity:

179

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

177.115g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

177.247g/mol

Monoisotopic Mass:

177.115g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

21.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7