Name: Name:5-(bromomethyl)-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one
Brand: Angene
SKU: AG01BVFU
Rating: 90 (10 reviews)

5-(bromomethyl)-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one

CAS No.:

245095-50-5

Catalog Number:

AG01BVFU

Molecular Formula:

C9H8BrNO2

Molecular Weight:

242.0693

Catalog Number:

AG01BVFU

Chemical Name:

5-(bromomethyl)-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one

CAS Number:

245095-50-5

Molecular Formula:

C9H8BrNO2

Molecular Weight:

242.0693

MDL Number:

MFCD30497582

IUPAC Name:

5-(bromomethyl)-3-methyl-1,3-benzoxazol-2-one

InChI:

InChI=1S/C9H8BrNO2/c1-11-7-4-6(5-10)2-3-8(7)13-9(11)12/h2-4H,5H2,1H3

InChI Key:

LUUQDSOABRXVSD-UHFFFAOYSA-N

SMILES:

BrCc1ccc2c(c1)n(C)c(=O)o2

Complexity:

222

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.974g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.072g/mol

Monoisotopic Mass:

240.974g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9