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MedKoo Cat#: 122600 | Name: 800CW acid
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

800CW acid (IRDye®800CW acid equivalent) is a near-infrared high water-soluble fluorescent dye with excitation/emission maximum 780/800 nm.

Chemical Structure

800CW acid
800CW acid
CAS#1088919-86-1

Theoretical Analysis

MedKoo Cat#: 122600

Name: 800CW acid

CAS#: 1088919-86-1

Chemical Formula: C46H51N2Na3O15S4

Exact Mass: 1068.1900

Molecular Weight: 1069.12

Elemental Analysis: C, 51.68; H, 4.81; N, 2.62; Na, 6.45; O, 22.45; S, 11.99

Price and Availability

Size Price Availability Quantity
1mg USD 550.00 2 Weeks
5mg USD 1,250.00 2 Weeks
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Related CAS #
No Data
Synonym
800CW acid; BP-25131
IUPAC/Chemical Name
sodium 1-(5-carboxypentyl)-2-((E)-2-((E)-3-(2-((E)-3,3-dimethyl-5-sulfonato-1-(4-sulfonatobutyl)indolin-2-ylidene)ethylidene)-2-(4-sulfonatophenoxy)cyclohex-1-en-1-yl)vinyl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate
InChi Key
QJGBIXAJRQRXGB-UHFFFAOYSA-K
InChi Code
InChI=1S/C46H54N2O15S4.3Na/c1-45(2)37-29-35(66(57,58)59)20-22-39(37)47(26-7-5-6-13-43(49)50)41(45)24-14-31-11-10-12-32(44(31)63-33-16-18-34(19-17-33)65(54,55)56)15-25-42-46(3,4)38-30-36(67(60,61)62)21-23-40(38)48(42)27-8-9-28-64(51,52)53;;;/h14-25,29-30H,5-13,26-28H2,1-4H3,(H4-,49,50,51,52,53,54,55,56,57,58,59,60,61,62);;;/q;3*+1/p-3
SMILES Code
CC(C1=C2C=CC(S(=O)(O[Na])=O)=C1)(C)/C(N2CCCCS(=O)([O-])=O)=C(\C([H])=C3CCCC(/C([H])=C(C4=[N+](CCCCCC(O)=O)C(C=CC(S(=O)(O[Na])=O)=C5)=C5C4(C)C)\[H])=C/3OC6=CC=C(S(=O)(O[Na])=O)C=C6)[H]
Appearance
To be determined
Purity
>90% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 1,069.12 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL