CAS
92992-32-0 Purity
96%
92992-32-0 Purity
96%
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8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester
CAS
929971-93-7
Catalog Number
ACM929971937
Category
Other Products
Molecular Weight
241.33
Molecular Formula
C13H23NO3
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Specification
Synonyms
8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic Acid 1,1-Dimethylethyl Ester;
IUPAC Name
tert-butyl 8-hydroxy-5-azaspiro[3.5]nonane-5-carboxylate
Canonical SMILES
CC(C)(C)OC(=O)N1CCC(CC12CCC2)O
InChI Key
HEGAYMHXIDYCSW-UHFFFAOYSA-N
Exact Mass
241.16800
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester?
The molecular formula is C13H23NO3.
What is the molecular weight of 8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester?
The molecular weight is 241.33 g/mol.
What are some synonyms for 8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester?
Some synonyms include tert-butyl 8-hydroxy-5-azaspiro[3.5]nonane-5-carboxylate and N-Boc-8-hydroxy-5-azaspiro[3.5]nonane.
What is the InChI of 8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester?
The InChI is InChI=1S/C13H23NO3/c1-12(2,3)17-11(16)14-8-5-10(15)9-13(14)6-4-7-13/h10,15H,4-9H2,1-3H3.
What is the InChIKey of 8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester?
The InChIKey is HEGAYMHXIDYCSW-UHFFFAOYSA-N.
How many hydrogen bond donor counts are there in 8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester?
There is 1 hydrogen bond donor count.
What is the heavy atom count of 8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester?
The heavy atom count is 17.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the complexity of 8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester?
The complexity is 304.
How many rotatable bond counts are there in 8-Hydroxy-5-azaspiro[3.5]nonane-5-carboxylic acid 1,1-dimethylethyl ester?
There are 2 rotatable bond counts.
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