AF594 NHS Ester - ≥95% , CAS No.295348-87-7

CAS: 295348-87-7 Cat. No.: C378964 Molecular Weight: 819.85

GRADE & PURITY ≥95%

Synonyms

TFAX 594,SE | 6-[2-Carboxy-4(5)-[[(2,5-dioxo-1-pyrrolidinyl)oxy]carbonyl]phenyl]-1,2,10,11-tetrahydro-1,2,2,10,10,11-hexamethyl-4,8-bis(sulfomethyl)pyrano[3,2-g:5,6-g']diquinolin-13-ium inner salt

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

TFAX 594, SE | 6-[2-Carboxy-4(5)-[[(2, 5-dioxo-1-pyrrolidinyl)oxy]carbonyl]phenyl]-1, 2, 10, 11-tetrahydro-1, 2, 2, 10, 10, 11-hexamethyl-4, 8-bis(sulfomethyl)pyrano[3, 2-g:5, 6-g']diquinolin-13-ium inner salt

Specifications & Purity

≥95%

Storage

Protected from light, Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 504769983
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504769983
• Canonical Smiles: CC1(C=C(C2=CC3=C(C=C2N1C)OC4=CC5=[N+](C(C=C(C5=CC4=C3C6=C(C=C(C=C6)C(=O)ON7C(=O)CCC7=O)C(=O)O)CS(=O)(=O)[O-])(C)C)C)CS(=O)(=O)O)C
• IUPAC Name: [13-[2-carboxy-4-(2,5-dioxopyrrolidin-1-yl)oxycarbonylphenyl]-6,7,7,19,19,20-hexamethyl-17-(sulfomethyl)-2-oxa-20-aza-6-azoniapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(14),3,5,8,10,12,15,17,21-nonaen-9-yl]methanesulfonate
• InChIKey: KWHCBZDWVYWWLE-UHFFFAOYSA-N
• INCHI: 1S/C39H37N3O13S2/c1-38(2)16-21(18-56(48,49)50)24-12-27-31(14-29(24)40(38)5)54-32-15-30-25(22(19-57(51,52)53)17-39(3,4)41(30)6)13-28(32)35(27)23-8-7-20(11-26(23)36(45)46)37(47)55-42-33(43)9-10-34(42)44/h7-8,11-17H,9-10,18-19H2,1-6H3,(H2-,45,46,48,49,50,51,52,53)
• Isomeric SMILES: CC1(C=C(C2=CC3=C(C=C2N1C)OC4=CC5=[N+](C(C=C(C5=CC4=C3C6=C(C=C(C=C6)C(=O)ON7C(=O)CCC7=O)C(=O)O)CS(=O)(=O)[O-])(C)C)C)CS(=O)(=O)O)C
• Molecular Weight: 819.85
• Reaxy-Rn: 14463757
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14463757&ln=

Chemical and Physical Properties

• Solubility: soluble in water, DMSO, DMF
• Sensitivity: Light sensitive