CAS
95946-00-2 Purity
96%
95946-00-2 Purity
96%
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Ethanone,1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]-
CAS
959490-91-6
Catalog Number
ACM959490916
Category
Other Products
Molecular Weight
286.411840 [g/mol]
Molecular Formula
C18H26N2O
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Specification
Synonyms
NCGC00010044, AC1MM3E6, PCOP-17146, KB-76889, 1-(3-benzyl-3,9-diazaspiro[5.5]undecan-9-yl)ethanone, Ethanone,1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]-, 959490-91-6
IUPAC Name
1-(9-benzyl-3,9-diazaspiro[5.5]undecan-3-yl)ethanone
SMILES
CC(=O)N1CCC2(CCN(CC2)CC3=CC=CC=C3)CC1
InChI Key
ZAWRNIMKTIGMCT-UHFFFAOYSA-N
Exact Mass
286.20500
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]?
The molecular formula is C18H26N2O.
When was Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl] created?
It was created on August 15, 2005.
What is the IUPAC name of Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]?
The IUPAC name is 1-(9-benzyl-3,9-diazaspiro[5.5]undecan-3-yl)ethanone.
What is the InChIKey of Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]?
The InChIKey is ZAWRNIMKTIGMCT-UHFFFAOYSA-N.
What is the molecular weight of Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]?
The molecular weight is 286.4 g/mol.
How many hydrogen bond donor counts are there in Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]?
There are 0 hydrogen bond donor counts.
What is the XLogP3-AA value of Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]?
The XLogP3-AA value is 2.3.
What is the exact mass of Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]?
The exact mass is 286.204513457 g/mol.
How many topological polar surface areas are present in Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl]?
The topological polar surface area is 23.6 Ų.
Is Ethanone, 1-[9-(phenylmethyl)-3,9-diazaspiro[5.5]undec-3-yl] a canonicalized compound?
Yes, it is a canonicalized compound.
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