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191354-48-0 | 2-Butanol, 1,4-dibromo-, 2-acetate, (2S)-
CAS No: 191354-48-0 Catalog No: AG002F6S MDL No:
Product Description
Catalog Number:
AG002F6S
Chemical Name:
2-Butanol, 1,4-dibromo-, 2-acetate, (2S)-
CAS Number:
191354-48-0
Molecular Formula:
C6H10Br2O2
Molecular Weight:
273.9504
IUPAC Name:
[(2S)-1,4-dibromobutan-2-yl] acetate
InChI:
InChI=1S/C6H10Br2O2/c1-5(9)10-6(4-8)2-3-7/h6H,2-4H2,1H3/t6-/m0/s1
InChI Key:
VZAIOAXQXLNVCN-LURJTMIESA-N
SMILES:
BrCC[C@H](OC(=O)C)CBr
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
273.903g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.952g/mol
Monoisotopic Mass:
271.905g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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