2-Pyrrolidinone, 3-bromo-


Chemical Name: 2-Pyrrolidinone, 3-bromo-
CAS Number: 40557-20-8
Product Number: AG00C6UC(AGN-PC-0MYTCE)
Synonyms:
MDL No:
Molecular Formula: C4H6BrNO
Molecular Weight: 164.0005

Identification/Properties


Properties
BP:
305.8±35.0°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Computed Properties
Molecular Weight:
164.002g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
162.963g/mol
Monoisotopic Mass:
162.963g/mol
Topological Polar Surface Area:
29.1A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
93.7
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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:
H302-H317
Precautionary Statements:
P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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