RH 237

Catalog Number

ACM83668911-1

CAS

83668-91-1

Structure

Synonyms

N-(4-Sulfobutyl)-4-(6-(4-(Dibutylamino)phenyl)hexatrienyl)Pyridinium,Inner Salt

IUPAC Name

4-[4-[(1E,3E,5E)-6-[4-(dibutylamino)phenyl]hexa-1,3,5-trienyl]pyridin-1-ium-1-yl]butane-1-sulfonate

Molecular Weight

496.71

Molecular Formula

C29H40N2O3S

Canonical SMILES

CCCCN(CCCC)C1=CC=C(C=C1)/C=C/C=C/C=C/C2=CC=[N+](C=C2)CCCCS(=O)(=O)[O-]

InChI

InChI=1S/C29H40N2O3S/c1-3-5-22-31(23-6-4-2)29-17-15-27(16-18-29)13-9-7-8-10-14-28-19-24-30(25-20-28)21-11-12-26-35(32,33)34/h7-10,13-20,24-25H,3-6,11-12,21-23,26H2,1-2H3

InChI Key

VJFBYTPFDXZYDN-UHFFFAOYSA-N

Melting Point

> 200 °C

Purity

95%+

Appearance

Black solid

Emission Maximum

782 nm

Excitation Maximum

528 nm

Packaging

1 mg/5 mg

• Catalog Number: ACM83668911-1
• CAS: 83668-91-1
• Synonyms: N-(4-Sulfobutyl)-4-(6-(4-(Dibutylamino)phenyl)hexatrienyl)Pyridinium,Inner Salt
• IUPAC Name: 4-[4-[(1E,3E,5E)-6-[4-(dibutylamino)phenyl]hexa-1,3,5-trienyl]pyridin-1-ium-1-yl]butane-1-sulfonate
• Molecular Weight: 496.71
• Molecular Formula: C29H40N2O3S
• Canonical SMILES: CCCCN(CCCC)C1=CC=C(C=C1)/C=C/C=C/C=C/C2=CC=[N+](C=C2)CCCCS(=O)(=O)[O-]
• InChI: InChI=1S/C29H40N2O3S/c1-3-5-22-31(23-6-4-2)29-17-15-27(16-18-29)13-9-7-8-10-14-28-19-24-30(25-20-28)21-11-12-26-35(32,33)34/h7-10,13-20,24-25H,3-6,11-12,21-23,26H2,1-2H3
• InChI Key: VJFBYTPFDXZYDN-UHFFFAOYSA-N
• Melting Point: > 200 °C
• Purity: 95%+
• Appearance: Black solid
• Emission Maximum: 782 nm
• Excitation Maximum: 528 nm
• Packaging: 1 mg/5 mg