Home Halogens 1-(5-bromo-2-methylthiophen-3-yl)ethan-1-one

1-(5-bromo-2-methylthiophen-3-yl)ethan-1-one

CAS No.:
1001671-82-4
Catalog Number:
AG019RQA
Molecular Formula:
C7H7BrOS
Molecular Weight:
219.0989
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019RQA
Chemical Name:
1-(5-bromo-2-methylthiophen-3-yl)ethan-1-one
CAS Number:
1001671-82-4
Molecular Formula:
C7H7BrOS
Molecular Weight:
219.0989
MDL Number:
MFCD20501932
IUPAC Name:
1-(5-bromo-2-methylthiophen-3-yl)ethanone
InChI:
InChI=1S/C7H7BrOS/c1-4(9)6-3-7(8)10-5(6)2/h3H,1-2H3
InChI Key:
NLXVUPFYNZJDSJ-UHFFFAOYSA-N
SMILES:
Brc1sc(c(c1)C(=O)C)C
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.94g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.096g/mol
Monoisotopic Mass:
217.94g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties