Methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Name: Methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate
Brand: ChemScene
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CAS No. 91489-09-7
Cat. No. CS-0220792
Purity≥98%
MDL No.None

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Each bottle is packed as an Excepted Quantity, with a maximum of 1g for items in class 6.1 packing group I or II, and up to 25g for all other hazardous materials.

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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+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

There is a HazMat shipping fee for each item that qualifies as a dangerous good. Please contact our quotation team via email to confirm the details.

*For research and further manufacturing use only, not for direct human use.

Methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate|CS-0220792

Structure of 91489-09-7

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General Information

CAS No. 91489-09-7
Cat. No. CS-0220792
Purity ≥98%
MDL No. None
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₁₂O₂S
Molecular Weight 196.27
Synonym(s) None
SMILES COC(=O)C1=CC2=C(CCCC2)S1

Synthesis

Route1
- 2365-48-2
- 1680-73-5
- ~34%
- 91489-09-7
References
- GLAXOSMITHKLINE LLC; HAYDAR, Simon N.; JOHNS, Brian Alvin; VELTHUISEN, Emile Johann Patent: WO2013/43553 A1, 2013 ; Location in patent: Page/Page column 115-116 ;
Route2
- 108-94-1
- ~%
- 91489-09-7
References
- GLAXOSMITHKLINE LLC; HAYDAR, Simon N.; JOHNS, Brian Alvin; VELTHUISEN, Emile Johann Patent: WO2013/43553 A1, 2013 ;

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 26.3
LogP 2.4135
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Thiophene compounds

Key Words

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Methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

CAS No. 91489-09-7

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General Information

Synthesis

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