Name: Name:6,8-difluoro-2,3,4,5-tetrahydro-1-benzoxepin-5-one
Brand: Angene
SKU: AG01APG8
Rating: 90 (10 reviews)

6,8-difluoro-2,3,4,5-tetrahydro-1-benzoxepin-5-one

CAS No.:

145348-28-3

Catalog Number:

AG01APG8

Molecular Formula:

C10H8F2O2

Molecular Weight:

198.1661

Catalog Number:

AG01APG8

Chemical Name:

6,8-difluoro-2,3,4,5-tetrahydro-1-benzoxepin-5-one

CAS Number:

145348-28-3

Molecular Formula:

C10H8F2O2

Molecular Weight:

198.1661

MDL Number:

MFCD17216140

IUPAC Name:

6,8-difluoro-3,4-dihydro-2H-1-benzoxepin-5-one

InChI:

InChI=1S/C10H8F2O2/c11-6-4-7(12)10-8(13)2-1-3-14-9(10)5-6/h4-5H,1-3H2

InChI Key:

CIIKURZNKXRZJL-UHFFFAOYSA-N

SMILES:

Fc1cc2OCCCC(=O)c2c(c1)F

Complexity:

232

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

198.049g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

198.169g/mol

Monoisotopic Mass:

198.049g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9