2-Propenoic acid, 2-methyl-, 2-bromoethyl ester


Chemical Name: 2-Propenoic acid, 2-methyl-, 2-bromoethyl ester
CAS Number: 4513-56-8
Product Number: AG007079(AGN-PC-0JLR95)
Synonyms:
MDL No:
Molecular Formula: C6H9BrO2
Molecular Weight: 193.0385

Identification/Properties


Computed Properties
Molecular Weight:
193.04g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
191.979g/mol
Monoisotopic Mass:
191.979g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
120
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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