CAS
93942-54-2 Purity
96%
93942-54-2 Purity
96%
![1,3-Benzenedisulfonicacid,4,4'-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)imino(6-chloro-1,3,5-triazine-4,2-diyl)imino]]bis[6-[[5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridiny](https://resource.alfa-chemistry.com/structure/93942-67-7.gif)
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Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate
CAS
93942-58-6
Catalog Number
ACM93942586
Category
Other Products
Molecular Weight
399.564640 [g/mol]
Molecular Formula
C22H41NO5
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Specification
Synonyms
EINECS 300-612-0, CID3023030, Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate, 93942-58-6
IUPAC Name
diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate
Canonical SMILES
CCOC(=O)CCCCCCC(C(=O)OCC)C(CCN)(C1CCCCC1)O
InChI Key
CDYSXCIYAMJFMJ-UHFFFAOYSA-N
EC Number
300-612-0
H-Bond Acceptor
6
H-Bond Donor
2
What is the molecular formula of Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate?
The molecular formula is C22H41NO5.
When was Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate created?
It was created on August 8, 2005.
What is the IUPAC name of Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate?
The IUPAC name is diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate.
What is the molecular weight of Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate?
The molecular weight is 399.6 g/mol.
What is the InChI key of Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate?
The InChI key is CDYSXCIYAMJFMJ-UHFFFAOYSA-N.
How many hydrogen bond donor count does Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate have?
It has 2 hydrogen bond donor counts.
What is the topological polar surface area of Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate?
The topological polar surface area is 98.8 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the XLogP3-AA value of Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate?
The XLogP3-AA value is 4.
How many rotatable bond counts does Diethyl 2-(3-amino-1-cyclohexyl-1-hydroxypropyl)nonanedioate have?
It has 16 rotatable bond counts.
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