CAS
92664-38-5 Purity
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92664-38-5 Purity
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3-Oxa-9-azabicyclo[3.3.1]nonan-7-one
CAS
926658-87-9
Catalog Number
ACM926658879
Category
Other Products
Molecular Weight
141.167740 [g/mol]
Molecular Formula
C7H11NO2
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Specification
Synonyms
SCHEMBL17349, NZOXKWYNXYBVGD-UHFFFAOYSA-N, AKOS006359127, 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one, 3-oxa-9-aza-bicyclo[3.3.1]nonan-7-one, DB-021684, 926658-87-9
IUPAC Name
3-oxa-9-azabicyclo[3.3.1]nonan-7-one
Canonical SMILES
C1C2COCC(N2)CC1=O
InChI Key
NZOXKWYNXYBVGD-UHFFFAOYSA-N
Boiling Point
262.9±40.0 °C (760 mmHg)
Density
1.136±0.06 g/cm³ (20 °C, 760 mmHg)
Exact Mass
141.07900
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one?
The molecular formula is C7H11NO2.
What is the molecular weight of 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one?
The molecular weight is 141.17 g/mol.
When was 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one created?
It was created on January 24, 2012.
When was 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one last modified?
It was last modified on December 30, 2023.
What is the IUPAC name of 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one?
The IUPAC name is 3-oxa-9-azabicyclo[3.3.1]nonan-7-one.
What is the InChI of 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one?
The InChI is InChI=1S/C7H11NO2/c9-7-1-5-3-10-4-6(2-7)8-5/h5-6,8H,1-4H2.
What is the InChIKey of 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one?
The InChIKey is NZOXKWYNXYBVGD-UHFFFAOYSA-N.
What is the canonical SMILES of 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one?
The canonical SMILES is C1C2COCC(N2)CC1=O.
What is the XLogP3-AA value of 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one?
The XLogP3-AA value is -1.
How many hydrogen bond donor and acceptor counts does 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one have?
It has 1 hydrogen bond donor count and 3 hydrogen bond acceptor count.
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