Name: Name:3-bromo-1-(1-methyl-1H-pyrazol-4-yl)pyrrolidin-2-one
Brand: Angene
SKU: AG01AHEJ
Rating: 90 (10 reviews)

3-bromo-1-(1-methyl-1H-pyrazol-4-yl)pyrrolidin-2-one

CAS No.:

1311314-47-2

Catalog Number:

AG01AHEJ

Molecular Formula:

C8H10BrN3O

Molecular Weight:

244.0885

Catalog Number:

AG01AHEJ

Chemical Name:

3-bromo-1-(1-methyl-1H-pyrazol-4-yl)pyrrolidin-2-one

CAS Number:

1311314-47-2

Molecular Formula:

C8H10BrN3O

Molecular Weight:

244.0885

MDL Number:

MFCD18483312

IUPAC Name:

3-bromo-1-(1-methylpyrazol-4-yl)pyrrolidin-2-one

InChI:

InChI=1S/C8H10BrN3O/c1-11-5-6(4-10-11)12-3-2-7(9)8(12)13/h4-5,7H,2-3H2,1H3

InChI Key:

JMVINFSKEVPFNI-UHFFFAOYSA-N

SMILES:

O=C1C(Br)CCN1c1cnn(c1)C

Complexity:

223

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.001g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

244.092g/mol

Monoisotopic Mass:

243.001g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5