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19078-72-9 | Benzeneacetyl chloride, α-bromo-
CAS No: 19078-72-9 Catalog No: AG002ETG MDL No:
Product Description
Catalog Number:
AG002ETG
Chemical Name:
Benzeneacetyl chloride, α-bromo-
CAS Number:
19078-72-9
Molecular Formula:
C8H6BrClO
Molecular Weight:
233.4896
IUPAC Name:
2-bromo-2-phenylacetyl chloride
InChI:
InChI=1S/C8H6BrClO/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H
InChI Key:
UDEJUBDPPQVWEX-UHFFFAOYSA-N
SMILES:
BrC(c1ccccc1)C(=O)Cl
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.929g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.489g/mol
Monoisotopic Mass:
231.929g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| Facile synthesis of structurally diverse 5-oxopiperazine-2-carboxylates as dipeptide mimics and templates. | Organic & biomolecular chemistry 20090821 |
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