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tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate

Catalog Number
ACMA00002316
Category
Ethers
Molecular Weight
272.34
Molecular Formula
C13H19NO2

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Specification

Hazard Statements
H319
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate?

The molecular formula is C13H24N2O4.

What are the synonyms for tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate?

The synonyms are 1251010-99-7, tert-butyl 1,11-dioxa-4,8-diazaspiro[5.6]dodecane-8-carboxylate, tert-butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate(SALTDATA: FREE), BAC01099.

What is the molecular weight of tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate?

The molecular weight is 272.34 g/mol.

What is the IUPAC name of tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate?

The IUPAC name is tert-butyl 1,11-dioxa-4,8-diazaspiro[5.6]dodecane-8-carboxylate.

What is the InChI of tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate?

The InChI is InChI=1S/C13H24N2O4/c1-12(2,3)19-11(16)15-5-7-17-10-13(9-15)8-14-4-6-18-13/h14H,4-10H2,1-3H3.

What is the InChIKey of tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate?

The InChIKey is MHCIEKBNVVEZOO-UHFFFAOYSA-N.

What is the Canonical SMILES of tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate?

The Canonical SMILES is CC(C)(C)OC(=O)N1CCOCC2(C1)CNCCO2.

What is the XLogP3-AA value of tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate?

The XLogP3-AA value is -0.2.

How many hydrogen bond acceptor counts does tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate have?

It has 5 hydrogen bond acceptor counts.

How many rotatable bond counts does tert-Butyl 1,8-dioxa-4,11-diazaspiro[5.6]dodecane-11-carboxylate have?

It has 2 rotatable bond counts.

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