Cas no 1227599-49-6 (2-(5-Fluoropyrimidin-2-yl)acetonitrile)

2-(5-Fluoropyrimidin-2-yl)acetonitrile is a fluorinated pyrimidine derivative with significant utility in pharmaceutical and agrochemical research. Its key structural features include a nitrile group and a fluoropyrimidine moiety, which enhance its reactivity and versatility as a synthetic intermediate. The fluorine substitution at the 5-position improves metabolic stability and binding affinity in target molecules, making it valuable for the development of bioactive compounds. This compound is particularly useful in nucleoside chemistry and heterocyclic synthesis, where its electron-withdrawing properties facilitate selective functionalization. High purity and consistent quality ensure reliable performance in complex organic transformations. Proper handling under controlled conditions is recommended due to its reactive nitrile group.
2-(5-Fluoropyrimidin-2-yl)acetonitrile structure
1227599-49-6 structure
Product Name:2-(5-Fluoropyrimidin-2-yl)acetonitrile
CAS No:1227599-49-6
MF:C6H4FN3
MW:137.114463806152
MDL:MFCD16611295
CID:4579233
PubChem ID:112692747
Update Time:2025-10-29

2-(5-Fluoropyrimidin-2-yl)acetonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-(5-Fluoropyrimidin-2-yl)acetonitrile
    • AKOS026732177
    • EN300-256423
    • G14869
    • 1227599-49-6
    • MDL: MFCD16611295
    • Inchi: 1S/C6H4FN3/c7-5-3-9-6(1-2-8)10-4-5/h3-4H,1H2
    • InChI Key: VYPOSBDIBQYDLM-UHFFFAOYSA-N
    • SMILES: FC1C=NC(CC#N)=NC=1

Computed Properties

  • Exact Mass: 137.03892530g/mol
  • Monoisotopic Mass: 137.03892530g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 142
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0
  • Topological Polar Surface Area: 49.6

2-(5-Fluoropyrimidin-2-yl)acetonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B435685-10mg
2-(5-Fluoropyrimidin-2-yl)acetonitrile
1227599-49-6
10mg
$ 70.00 2022-06-07
TRC
B435685-50mg
2-(5-Fluoropyrimidin-2-yl)acetonitrile
1227599-49-6
50mg
$ 250.00 2022-06-07
TRC
B435685-100mg
2-(5-Fluoropyrimidin-2-yl)acetonitrile
1227599-49-6
100mg
$ 365.00 2022-06-07
Chemenu
CM421288-250mg
2-(5-fluoropyrimidin-2-yl)acetonitrile
1227599-49-6 95%+
250mg
$576 2023-02-03
Chemenu
CM421288-500mg
2-(5-fluoropyrimidin-2-yl)acetonitrile
1227599-49-6 95%+
500mg
$892 2023-02-03
Chemenu
CM421288-1g
2-(5-fluoropyrimidin-2-yl)acetonitrile
1227599-49-6 95%+
1g
$1137 2023-02-03
Enamine
EN300-256423-0.05g
2-(5-fluoropyrimidin-2-yl)acetonitrile
1227599-49-6 95%
0.05g
$245.0 2024-06-19
Enamine
EN300-256423-0.1g
2-(5-fluoropyrimidin-2-yl)acetonitrile
1227599-49-6 95%
0.1g
$366.0 2024-06-19
Enamine
EN300-256423-0.25g
2-(5-fluoropyrimidin-2-yl)acetonitrile
1227599-49-6 95%
0.25g
$524.0 2024-06-19
Enamine
EN300-256423-0.5g
2-(5-fluoropyrimidin-2-yl)acetonitrile
1227599-49-6 95%
0.5g
$824.0 2024-06-19

2-(5-Fluoropyrimidin-2-yl)acetonitrile Related Literature

Recommended suppliers
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hubei Cuiyuan Biotechnology Co.,Ltd
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hebei Liye chemical Co.,Ltd
Shenzhen Yaoyuan R&D Center Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shenzhen Yaoyuan R&D Center Co.,Ltd
Hunan Well Medicine Synthesis Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hunan Well Medicine Synthesis Technology Co., Ltd.