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819079-69-1 | Acetyl bromide, (methylsulfonyl)-
CAS No: 819079-69-1 Catalog No: AG005GD1 MDL No:
Product Description
Catalog Number:
AG005GD1
Chemical Name:
Acetyl bromide, (methylsulfonyl)-
CAS Number:
819079-69-1
Molecular Formula:
C3H5BrO3S
Molecular Weight:
201.0390
IUPAC Name:
2-methylsulfonylacetyl bromide
InChI:
InChI=1S/C3H5BrO3S/c1-8(6,7)2-3(4)5/h2H2,1H3
InChI Key:
PFNOSNGEFQEHMU-UHFFFAOYSA-N
SMILES:
BrC(=O)CS(=O)(=O)C
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.914g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.034g/mol
Monoisotopic Mass:
199.914g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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