CAS
98421-25-1 Purity
98%
98421-25-1 Purity
98%
![(8R,9S,10R,13S,14S,17R)-17-Hydroxy-10,13-dimethyl-17-[2-(propylamino)-1,3-thiazol-4-yl]-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one](https://resource.alfa-chemistry.com/structure/98424-37-4.gif)
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1-Hexyn-3-ol,3-methyl-,carbamate(9ci)
CAS
98426-09-6
Catalog Number
ACM98426096
Category
Other Products
Molecular Formula
C8H13NO2
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Specification
Synonyms
1-Hexyn-3-ol,3-methyl-,carbamate(9CI)
What is the molecular formula of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
The molecular formula of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci) is C8H13NO2.
What is the molecular weight of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
The molecular weight of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci) is 155.19 g/mol.
What is the IUPAC name of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
The IUPAC name of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci) is 3-methylhex-1-yn-3-yl carbamate.
What is the InChI of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
The InChI of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci) is InChI=1S/C8H13NO2/c1-4-6-8(3,5-2)11-7(9)10/h2H,4,6H2,1,3H3,(H2,9,10).
What is the Canonical SMILES of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
The Canonical SMILES of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci) is CCCC(C)(C#C)OC(=O)N.
What is the XLogP3-AA value of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
The XLogP3-AA value of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci) is 1.1.
How many hydrogen bond donor counts are there in 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
There is 1 hydrogen bond donor count in 1-Hexyn-3-ol,3-methyl-,carbamate(9ci).
What is the topological polar surface area of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
The topological polar surface area of 1-Hexyn-3-ol,3-methyl-,carbamate(9ci) is 52.3 A^2.
Is the compound canonicalized in 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
Yes, the compound is canonicalized in 1-Hexyn-3-ol,3-methyl-,carbamate(9ci).
How many rotatable bond counts are there in 1-Hexyn-3-ol,3-methyl-,carbamate(9ci)?
There are 5 rotatable bond counts in 1-Hexyn-3-ol,3-methyl-,carbamate(9ci).
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