Name: Name:5-(3-chlorophenyl)-4-(hydroxymethyl)-1-methylpyrrolidin-2-one
Brand: Angene
SKU: AG01AJRO
Rating: 90 (10 reviews)

5-(3-chlorophenyl)-4-(hydroxymethyl)-1-methylpyrrolidin-2-one

CAS No.:

1334149-48-2

Catalog Number:

AG01AJRO

Molecular Formula:

C12H14ClNO2

Molecular Weight:

239.6981

Catalog Number:

AG01AJRO

Chemical Name:

5-(3-chlorophenyl)-4-(hydroxymethyl)-1-methylpyrrolidin-2-one

CAS Number:

1334149-48-2

Molecular Formula:

C12H14ClNO2

Molecular Weight:

239.6981

MDL Number:

MFCD19686352

IUPAC Name:

5-(3-chlorophenyl)-4-(hydroxymethyl)-1-methylpyrrolidin-2-one

InChI:

InChI=1S/C12H14ClNO2/c1-14-11(16)6-9(7-15)12(14)8-3-2-4-10(13)5-8/h2-5,9,12,15H,6-7H2,1H3

InChI Key:

XYPXKAUXYJTSMD-UHFFFAOYSA-N

SMILES:

OCC1CC(=O)N(C1c1cccc(c1)Cl)C

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

239.071g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

239.699g/mol

Monoisotopic Mass:

239.071g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2