Quinuclidin-3-yldi(thiophen-2-yl)methanol

Name: Quinuclidin-3-yldi(thiophen-2-yl)methanol
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CAS No. 57734-75-5
Cat. No. CS-0331733
Purity95+%
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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Quinuclidin-3-yldi(thiophen-2-yl)methanol|CS-0331733

Structure of 57734-75-5

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General Information

CAS No. 57734-75-5
Cat. No. CS-0331733
Purity 95+%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₆H₁₉NOS₂
Molecular Weight 305.46
Synonym(s) 1-azabicyclo[2.2.2]octan-3-yl(dithiophen-2-yl)methanol
SMILES C1=CSC(=C1)C(C2CN3CCC2CC3)(C4=CC=CS4)O

Synthesis

Route1
- 6238-33-1
- 5713-61-1
- ~%
- 57734-75-5
References
- Kaminka,M.E. et al. Pharmaceutical Chemistry Journal, 1977 , vol. 11, # 2 p. 169 - 172 Khimiko-Farmatsevticheskii Zhurnal, 1977 , vol. 11, # 2 p. 24 - 28
Route2
- 1003-09-4
- 6238-33-1
- ~%
- 57734-75-5
References
- Mikhlina,E.E. et al. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1976 , vol. 12, p. 776 - 780 Khimiya Geterotsiklicheskikh Soedinenii, 1976 , vol. 12, p. 935 - 939

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 23.47
LogP 3.3873
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Skeleton Bridge Rings compounds Quinine Ring compounds

Building Blocks Skeleton Aromatic heterocycle compounds Thiophene compounds

Key Words

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Quinuclidin-3-yldi(thiophen-2-yl)methanol

CAS No. 57734-75-5

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Synthesis

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