Cy3.5 carboxylic acid

Catalog Number

ACM1144107798-1

CAS

1144107-79-8

Synonyms

Cy3.5-carboxylicacidchloride

IUPAC Name

6-[(2Z)-1,1-dimethyl-2-[(E)-3-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]benzo[e]indol-3-yl]hexanoicacid;chloride

Molecular Weight

593.2

Molecular Formula

C38H41ClN2O2

Canonical SMILES

CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)C=CC=C4C(C5=C(N4CCCCCC(=O)O)C=CC6=CC=CC=C65)(C)C)C.[Cl-]

InChI

InChI=1S/C38H40N2O2.ClH/c1-37(2)32(39(5)30-23-21-26-14-8-10-16-28(26)35(30)37)18-13-19-33-38(3,4)36-29-17-11-9-15-27(29)22-24-31(36)40(33)25-12-6-7-20-34(41)42;/h8-11,13-19,21-24H,6-7,12,20,25H2,1-5H3;1H

InChI Key

VJCYHFMXCZYHEG-UHFFFAOYSA-N

Purity

95%

Storage

-20 °C

• Catalog Number: ACM1144107798-1
• CAS: 1144107-79-8
• Synonyms: Cy3.5-carboxylicacidchloride
• IUPAC Name: 6-[(2Z)-1,1-dimethyl-2-[(E)-3-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]benzo[e]indol-3-yl]hexanoicacid;chloride
• Molecular Weight: 593.2
• Molecular Formula: C38H41ClN2O2
• Canonical SMILES: CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)C=CC=C4C(C5=C(N4CCCCCC(=O)O)C=CC6=CC=CC=C65)(C)C)C.[Cl-]
• InChI: InChI=1S/C38H40N2O2.ClH/c1-37(2)32(39(5)30-23-21-26-14-8-10-16-28(26)35(30)37)18-13-19-33-38(3,4)36-29-17-11-9-15-27(29)22-24-31(36)40(33)25-12-6-7-20-34(41)42;/h8-11,13-19,21-24H,6-7,12,20,25H2,1-5H3;1H
• InChI Key: VJCYHFMXCZYHEG-UHFFFAOYSA-N
• Purity: 95%
• Storage: -20 °C