CAS
915924-69-5 Purity
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915924-69-5 Purity
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Chembrdg-bb 4014696
CAS
915924-81-1
Catalog Number
ACM915924811
Category
Other Products
Molecular Weight
225.28
Molecular Formula
C12H19NO3
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Specification
Synonyms
CHEMBRDG-BB 4014696;1-(TETRAHYDRO-2H-PYRAN-2-YLMETHYL)AZEPANE-2,5-DIONE
What is the molecular formula of Chembrdg-bb 4014696?
The molecular formula of Chembrdg-bb 4014696 is C12H19NO3.
What is the molecular weight of Chembrdg-bb 4014696?
The molecular weight of Chembrdg-bb 4014696 is 225.28 g/mol.
When was Chembrdg-bb 4014696 created and last modified?
Chembrdg-bb 4014696 was created on 2010-03-22 and last modified on 2023-12-30.
What is the IUPAC name of Chembrdg-bb 4014696?
The IUPAC name of Chembrdg-bb 4014696 is 1-(oxan-2-ylmethyl)azepane-2,5-dione.
What is the InChI of Chembrdg-bb 4014696?
The InChI of Chembrdg-bb 4014696 is InChI=1S/C12H19NO3/c14-10-4-5-12(15)13(7-6-10)9-11-3-1-2-8-16-11/h11H,1-9H2.
What is the InChIKey of Chembrdg-bb 4014696?
The InChIKey of Chembrdg-bb 4014696 is NTCJVQCRBVNEAZ-UHFFFAOYSA-N.
What is the canonical SMILES representation of Chembrdg-bb 4014696?
The canonical SMILES representation of Chembrdg-bb 4014696 is C1CCOC(C1)CN2CCC(=O)CCC2=O.
How many hydrogen bond acceptors does Chembrdg-bb 4014696 have?
Chembrdg-bb 4014696 has 3 hydrogen bond acceptor counts.
What is the topological polar surface area of Chembrdg-bb 4014696?
The topological polar surface area of Chembrdg-bb 4014696 is 46.6 A2.
Is the compound Chembrdg-bb 4014696 canonicalized?
Yes, the compound Chembrdg-bb 4014696 is canonicalized.
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