Home Halogens tert-butyl 2,3-dibromopropanoate

tert-butyl 2,3-dibromopropanoate

CAS No.:
49855-41-6
Catalog Number:
AG01DWG8
Molecular Formula:
C7H12Br2O2
Molecular Weight:
287.9770
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Product Description
Catalog Number:
AG01DWG8
Chemical Name:
tert-butyl 2,3-dibromopropanoate
CAS Number:
49855-41-6
Molecular Formula:
C7H12Br2O2
Molecular Weight:
287.9770
MDL Number:
MFCD31664932
IUPAC Name:
tert-butyl 2,3-dibromopropanoate
InChI:
InChI=1S/C7H12Br2O2/c1-7(2,3)11-6(10)5(9)4-8/h5H,4H2,1-3H3
InChI Key:
PFUYTJUZEPQIIF-UHFFFAOYSA-N
SMILES:
BrCC(C(=O)OC(C)(C)C)Br
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.918g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.979g/mol
Monoisotopic Mass:
285.92g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties