Structure

N-(hydroxy-PEG2)-N'-(azide-PEG3)-Cy5

CAS
2226235-96-5
Catalog Number
ACM2226235965-1
Category
Cyanine Fluorophores
Molecular Weight
724.3
Molecular Formula
C39H54ClN5O6

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Specification

IUPAC Name
2-[2-[2-[2-[(1E,3E)-5-[1-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]-3,3-dimethylindol-2-ylidene]penta-1,3-dienyl]-3,3-dimethylindol-1-ium-1-yl]ethoxy]ethoxy]ethanol;chloride
SMILES
CC1(C2=CC=CC=C2[N+](=C1/C=C/C=C/C=C3C(C4=CC=CC=C4N3CCOCCOCCOCCN=[N+]=[N-])(C)C)CCOCCOCCO)C.[Cl-]
InChI
InChI=1S/C39H54N5O6.ClH/c1-38(2)32-12-8-10-14-34(32)43(19-23-47-27-29-49-25-21-45)36(38)16-6-5-7-17-37-39(3,4)33-13-9-11-15-35(33)44(37)20-24-48-28-31-50-30-26-46-22-18-41-42-40;/h5-17,45H,18-31H2,1-4H3;1H/q+1;/p-1
InChI Key
XDWWTFOMGZZKBB-UHFFFAOYSA-M
Storage
-20 ºC
What is the molecular formula of 1-Pentyl-3-(1-naphthoyl)indole?

The molecular formula is C24H23NO.

What is the molecular weight of 1-Pentyl-3-(1-naphthoyl)indole?

The molecular weight is 341.4 g/mol.

When was JWH 018 created?

It was created on 2006-10-25.

What is the IUPAC name of 1-Pentyl-3-(1-naphthoyl)indole?

The IUPAC name is naphthalen-1-yl-(1-pentylindol-3-yl)methanone.

What is the InChIKey of 1-Pentyl-3-(1-naphthoyl)indole?

The InChIKey is JDNLPKCAXICMBW-UHFFFAOYSA-N.

What is the Canonical SMILES of 1-Pentyl-3-(1-naphthoyl)indole?

The Canonical SMILES is CCCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=CC4=CC=CC=C43.

What is the CAS number of 1-Pentyl-3-(1-naphthoyl)indole?

The CAS number is 209414-07-3.

How many hydrogen bond donor counts does 1-Pentyl-3-(1-naphthoyl)indole have?

It has 0 hydrogen bond donor counts.

What is the rotatable bond count of 1-Pentyl-3-(1-naphthoyl)indole?

It has 6 rotatable bonds.

What is the topological polar surface area of 1-Pentyl-3-(1-naphthoyl)indole?

The topological polar surface area is 22.2.

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