Name: Name:7,8-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-5-one
Brand: Angene
SKU: AG01AI88
Rating: 90 (10 reviews)

7,8-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-5-one

CAS No.:

32557-51-0

Catalog Number:

AG01AI88

Molecular Formula:

C12H14O2

Molecular Weight:

190.2384

Catalog Number:

AG01AI88

Chemical Name:

7,8-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-5-one

CAS Number:

32557-51-0

Molecular Formula:

C12H14O2

Molecular Weight:

190.2384

MDL Number:

MFCD01648763

IUPAC Name:

7,8-dimethyl-3,4-dihydro-2H-1-benzoxepin-5-one

InChI:

InChI=1S/C12H14O2/c1-8-6-10-11(13)4-3-5-14-12(10)7-9(8)2/h6-7H,3-5H2,1-2H3

InChI Key:

GTEWXKXDPKAORN-UHFFFAOYSA-N

SMILES:

O=C1CCCOc2c1cc(C)c(c2)C

Complexity:

224

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.099g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.242g/mol

Monoisotopic Mass:

190.099g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5