Home Halogens methyl 2-(3-bromo-2-oxopyrrolidin-1-yl)thiophene-3-carboxylate

methyl 2-(3-bromo-2-oxopyrrolidin-1-yl)thiophene-3-carboxylate

CAS No.:
1375471-71-8
Catalog Number:
AG019SSW
Molecular Formula:
C10H10BrNO3S
Molecular Weight:
304.1603
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Product Description
Catalog Number:
AG019SSW
Chemical Name:
methyl 2-(3-bromo-2-oxopyrrolidin-1-yl)thiophene-3-carboxylate
CAS Number:
1375471-71-8
Molecular Formula:
C10H10BrNO3S
Molecular Weight:
304.1603
MDL Number:
MFCD21602460
IUPAC Name:
methyl 2-(3-bromo-2-oxopyrrolidin-1-yl)thiophene-3-carboxylate
InChI:
InChI=1S/C10H10BrNO3S/c1-15-10(14)6-3-5-16-9(6)12-4-2-7(11)8(12)13/h3,5,7H,2,4H2,1H3
InChI Key:
ZIWNELSOOBYSMR-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccsc1N1CCC(C1=O)Br
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.956g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.158g/mol
Monoisotopic Mass:
302.956g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties