Home Halogens 3-bromo-1-(4-methylphenyl)pyrrolidin-2-one

3-bromo-1-(4-methylphenyl)pyrrolidin-2-one

CAS No.:
1282220-90-9
Catalog Number:
AG01AKXS
Molecular Formula:
C11H12BrNO
Molecular Weight:
254.1231
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Product Description
Catalog Number:
AG01AKXS
Chemical Name:
3-bromo-1-(4-methylphenyl)pyrrolidin-2-one
CAS Number:
1282220-90-9
Molecular Formula:
C11H12BrNO
Molecular Weight:
254.1231
MDL Number:
MFCD16991879
IUPAC Name:
3-bromo-1-(4-methylphenyl)pyrrolidin-2-one
InChI:
InChI=1S/C11H12BrNO/c1-8-2-4-9(5-3-8)13-7-6-10(12)11(13)14/h2-5,10H,6-7H2,1H3
InChI Key:
CBHGLEBQOJIZEU-UHFFFAOYSA-N
SMILES:
BrC1CCN(C1=O)c1ccc(cc1)C
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.01g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.127g/mol
Monoisotopic Mass:
253.01g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties