66159

2-Chloro-3-methyl-4-[(7R,7aS)-tetrahydro-7-hydroxy-1,3-dioxo-1H-pyrrolo[1,2-c]imidazol-2(3H)-yl]benzonitrile

analytical standard

• Synonym(s): BMS 564929
• Empirical Formula (Hill Notation): C₁₄H₁₂ClN₃O₃
• CAS Number: 627530-84-1
• Molecular Weight: 305.72
• Beilstein: 11053870
• MDL number: MFCD15146692
• UNSPSC Code: 41116107
• PubChem Substance ID: 329760209
• NACRES: NA.24

Properties

• grade: analytical standard
• Quality Level: 100
• Assay: ≥98.0% (TLC)
• shelf life: limited shelf life, expiry date on the label
• technique(s): HPLC: suitable; gas chromatography (GC): suitable
• application(s): forensics and toxicology; pharmaceutical (small molecule)
• format: neat
• SMILES string: O=C([C@@]1([H])N2CC[C@H]1O)N(C3=C(C)C(Cl)=C(C#N)C=C3)C2=O
• InChI: 1S/C14H12ClN3O3/c1-7-9(3-2-8(6-16)11(7)15)18-13(20)12-10(19)4-5-17(12)14(18)21/h2-3,10,12,19H,4-5H2,1H3/t10-,12+/m1/s1
• InChI key: KEJORAMIZFOODM-PWSUYJOCSA-N

Description

Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Statements: H302
• Hazard Classifications: Acute Tox. 4 Oral
• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable