3-Ethyl-1,1,2-trimethyl-8-sulfo-1H-benzo[e]indol-3-ium-6-sulfonate

Name: 3-Ethyl-1,1,2-trimethyl-8-sulfo-1H-benzo[e]indol-3-ium-6-sulfonate
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CAS No. 791576-54-0
Cat. No. CS-0173444
Purity≥98%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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3-Ethyl-1,1,2-trimethyl-8-sulfo-1H-benzo[e]indol-3-ium-6-sulfonate|CS-0173444

Structure of 791576-54-0

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General Information

CAS No. 791576-54-0
Cat. No. CS-0173444
Purity ≥98%
MDL No. None
Storage Store at room temperature, keep dry and cool
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₇H₁₉NO₆S₂
Molecular Weight 397.47
Synonym(s) None
SMILES O=S([O-])(C1=CC(S(=O)(O)=O)=CC2=C1C=CC3=C2C(C)(C)C(C)=[N+]3CC)=O

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 114.58
LogP 2.4066
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Indole compounds

Key Words

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3-Ethyl-1,1,2-trimethyl-8-sulfo-1H-benzo[e]indol-3-ium-6-sulfonate

CAS No. 791576-54-0

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