MedKoo Cat#: 122727 | Name: AUN00953
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Description:

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

AUN00953, also known as BP Fluor 568 DBCO, reacts with azides via a copper-free click chemistry reaction to form a stable triazole and does not require Cu-catalyst or elevated temperatures.

Chemical Structure

AUN00953
AUN00953
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 122727

Name: AUN00953

CAS#: N/A

Chemical Formula: C51H44N4O11S2

Exact Mass: 952.2400

Molecular Weight: 953.05

Elemental Analysis: C, 64.27; H, 4.65; N, 5.88; O, 18.47; S, 6.73

Price and Availability

Size Price Availability Quantity
1mg USD 500.00 2 Weeks
5mg USD 1,100.00 2 Weeks
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Related CAS #
No Data
Synonym
AUN00953; AUN-00953; AUN 00953; APDye 568 DBCO; BP Fluor 568 DBCO
IUPAC/Chemical Name
[13-[4-[[3-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]carbamoyl]-2-carboxyphenyl]-7,7,19,19-tetramethyl-17-(sulfomethyl)-2-oxa-6-aza-20-azoniapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3(12),4,8,10,13,15,17,20-nonaen-9-yl]methanesulfonate
InChi Key
AVTBIRHZJFFSIL-UHFFFAOYSA-N
InChi Code
InChI=1S/C51H44N4O11S2/c1-50(2)24-33(27-67(60,61)62)36-20-39-44(22-41(36)53-50)66-45-23-42-37(34(28-68(63,64)65)25-51(3,4)54-42)21-40(45)47(39)35-16-15-31(19-38(35)49(58)59)48(57)52-18-17-46(56)55-26-32-11-6-5-9-29(32)13-14-30-10-7-8-12-43(30)55/h5-12,15-16,19-25,53H,17-18,26-28H2,1-4H3,(H,52,57)(H,58,59)(H,60,61,62)(H,63,64,65)
SMILES Code
O=S(CC1=CC(C)(C)NC2=CC(OC3=CC4=[NH+]C(C)(C)C=C(CS(=O)(O)=O)C4=CC3=C5C6=CC=C(C(NCCC(N7C8=CC=CC=C8C#CC9=CC=CC=C9C7)=O)=O)C=C6C(O)=O)=C5C=C12)([O-])=O
Appearance
To be determined
Purity
>95% (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 953.05 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