Lot numbers can be found on the outside label of a product:
trans-4-(Methylamino)cyclohexanol
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CAS No. 22348-44-3
- Cat. No. CS-W019271
- Purity≥98%
- MDL No.MFCD09954372
*For research and further manufacturing use only, not for direct human use.
Structure of 22348-44-3
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General Information
- CAS No. 22348-44-3
- Cat. No. CS-W019271
- Purity ≥98%
- MDL No. MFCD09954372
- Storage 4°C
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₇H₁₅NO
- Molecular Weight 129.20
- Synonym(s) trans-4-(Methylamino)cyclohexan-1-ol
- SMILES O[C@H]1CC[C@H](NC)CC1
Description
trans-4-(Methylamino)cyclohexanol features a sterically accessible cyclohexanol scaffold with a methylamino group in the equatorial position, enhancing solubility and metabolic stability. This configuration enables efficient integration into chiral building blocks for medicinal chemistry, particularly in CNS-targeted compound design. The molecule exhibits bench-stable handling characteristics under standard conditions.
Application
trans-4-(Methylamino)cyclohexanol serves as a versatile chiral building block in medicinal chemistry, enabling the synthesis of bioactive heterocycles and pharmacologically relevant scaffolds. Its stable trans-configured cyclohexane ring and pendant amine functionality offer predictable stereochemical control and compatibility with standard functional group transformations. The molecule functions effectively in reductive amination, acylation, and cyclization protocols, facilitating efficient access to complex nitrogen-containing frameworks under routine laboratory conditions.
Synthesis
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Route1
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In-stock
111300-06-2 - ~90%
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In-stock
22348-44-3
References
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ALMIRALL, S.A.; AIGUADE BOSCH, Jose; GUAL ROIG, Silvia; PRAT QUINONES, Maria; PUIG DURAN, Carlos Patent: WO2013/68552 A1, 2013 ; Location in patent: Page/Page column 39 ;
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Route2
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541-41-3 -
In-stock
50910-54-8 - ~%
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In-stock
22348-44-3
References
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CORTEX PHARMACEUTICALS, INC. Patent: WO2008/143963 A1, 2008 ; Location in patent: Example 51 ;
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Route3
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In-stock
27489-63-0 - ~80%
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In-stock
22348-44-3
References
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Dehmlow, Henrietta; Ackermann, Jean; Aebi, Johannes; Blum-Kaelin, Denise; Chucholowski, Alexander; Coassolo, Philippe; Hartman, Peter; Kansy, Manfred; Maerki, Hans Peter; Morand, Olivier; Von Der Mark, Elisabeth; Panday, Narendra; Ruf, Armin; Thoma, Ralf; Schulz-Gasch, Tanja Chimia, 2005 , vol. 59, # 3 p. 72 - 76
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Quality Control
Computational Chemistry Data
- TPSA 32.26
- LogP 0.5093
- H_Acceptors 2
- H_Donors 2
- Rotatable_Bonds 1
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Key Words
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