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CAS Number: 40557-20-8
3-bromopyrrolidin-2-one

Structure

 3-bromopyrrolidin-2-one
Name: 3-bromopyrrolidin-2-one
Synonyms:
General Information
Product Number: 40557208

CAS Registry Number 40557-20-8
Name:
2-?Pyrrolidinone, 3-?bromo-
3-Bromo-2-pyrrolidone
3-Bromopyrrolidin-2-one
α-Bromobutyrolactam

 

Chemical Formula: C4H6BrNO
Exact Mass: 162.96
Molecular Weight: 164.00
m/z: 162.96 (100.0%), 164.96 (97.3%), 165.96 (4.6%), 163.97 (4.4%)

 

InChI:InChI=1S/C4H6BrNO/c5-3-1-2-6-4(3)7/h3H,1-2H2,(H,6,7)

InChI Key:GVPDRYJFYUWXQK-UHFFFAOYSA-N

Canonical SMILES:C1CNC(=O)C1Br

 

Thermal Properties Value Condition Note
Melting Point 83 °C   (2)CAS
Melting Point 79-81 °C   (3)CAS

Specification

98%
References
  1. (2) Korte, Friedhelm; Chemische Berichte 1964, V97(7), P1970-80 CAPLUS
  2. (3) Kamal, Ahmed; Tetrahedron: Asymmetry 2003, V14(17), P2587-2594 CAPLUS
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