Home Halogens 4-(5-bromothiophen-2-yl)pyrrolidin-2-one

4-(5-bromothiophen-2-yl)pyrrolidin-2-one

CAS No.:
133933-69-4
Catalog Number:
AG01BKED
Molecular Formula:
C8H8BrNOS
Molecular Weight:
246.1242
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Product Description
Catalog Number:
AG01BKED
Chemical Name:
4-(5-bromothiophen-2-yl)pyrrolidin-2-one
CAS Number:
133933-69-4
Molecular Formula:
C8H8BrNOS
Molecular Weight:
246.1242
MDL Number:
MFCD22169441
IUPAC Name:
4-(5-bromothiophen-2-yl)pyrrolidin-2-one
InChI:
InChI=1S/C8H8BrNOS/c9-7-2-1-6(12-7)5-3-8(11)10-4-5/h1-2,5H,3-4H2,(H,10,11)
InChI Key:
AQVVXYCITHQFEI-UHFFFAOYSA-N
SMILES:
O=C1NCC(C1)c1ccc(s1)Br
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.951g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
246.122g/mol
Monoisotopic Mass:
244.951g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties