Name: Name:3-bromo-1-(2,4,6-trimethylphenyl)pyrrolidin-2-one
Brand: Angene
SKU: AG01BCXS
Rating: 90 (10 reviews)

3-bromo-1-(2,4,6-trimethylphenyl)pyrrolidin-2-one

CAS No.:

1344114-08-4

Catalog Number:

AG01BCXS

Molecular Formula:

C13H16BrNO

Molecular Weight:

282.1762

Catalog Number:

AG01BCXS

Chemical Name:

3-bromo-1-(2,4,6-trimethylphenyl)pyrrolidin-2-one

CAS Number:

1344114-08-4

Molecular Formula:

C13H16BrNO

Molecular Weight:

282.1762

MDL Number:

MFCD18886544

IUPAC Name:

3-bromo-1-(2,4,6-trimethylphenyl)pyrrolidin-2-one

InChI:

InChI=1S/C13H16BrNO/c1-8-6-9(2)12(10(3)7-8)15-5-4-11(14)13(15)16/h6-7,11H,4-5H2,1-3H3

InChI Key:

HPDOQSIHHINQIG-UHFFFAOYSA-N

SMILES:

BrC1CCN(C1=O)c1c(C)cc(cc1C)C

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

281.042g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.181g/mol

Monoisotopic Mass:

281.042g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

20.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3