Propanoic acid, 3-bromo-2-(bromomethyl)-, methyl ester


Chemical Name: Propanoic acid, 3-bromo-2-(bromomethyl)-, methyl ester
CAS Number: 22262-60-8
Product Number: AG003RRD(AGN-PC-0JMRN0)
Synonyms:
MDL No:
Molecular Formula: C5H8Br2O2
Molecular Weight: 259.9238

Identification/Properties


Properties
BP:
246.9±0.0°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.508(lit.)
Computed Properties
Molecular Weight:
259.925g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
259.887g/mol
Monoisotopic Mass:
257.889g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
91
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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