CAS
94157-89-8 Purity
96%
94157-89-8 Purity
96%
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1-Acetylpyrrolidine-2-ethanol
CAS
94157-94-5
Catalog Number
ACM94157945
Category
Other Products
Molecular Weight
157.210200 [g/mol]
Molecular Formula
C8H15NO2
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Specification
Synonyms
1-Acetylpyrrolidine-2-ethanol, EINECS 303-063-5, MolPort-004-772-282, CID11971297, 94157-94-5
IUPAC Name
1-[2-(2-hydroxyethyl)pyrrolidin-1-yl]ethanone
InChI Key
YFIUCVYOKJUGSF-UHFFFAOYSA-N
Boiling Point
307ºC at 760mmHg
Flash Point
139.4ºC
Density
1.075g/cm³
Exact Mass
157.11000
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 1-Acetylpyrrolidine-2-ethanol according to the reference?
The molecular formula of 1-Acetylpyrrolidine-2-ethanol is C8H15NO2.
When was 1-Acetylpyrrolidine-2-ethanol created and modified in PubChem?
It was created on December 27, 2006, and last modified on December 30, 2023.
What is the IUPAC Name of 1-Acetylpyrrolidine-2-ethanol?
The IUPAC Name is 1-[2-(2-hydroxyethyl)pyrrolidin-1-yl]ethanone.
What is the InChIKey of 1-Acetylpyrrolidine-2-ethanol?
The InChIKey is YFIUCVYOKJUGSF-UHFFFAOYSA-N.
What is the canonical SMILES representation of 1-Acetylpyrrolidine-2-ethanol?
The canonical SMILES representation is CC(=O)N1CCCC1CCO.
What is the CAS number of 1-Acetylpyrrolidine-2-ethanol?
The CAS number is 94157-94-5.
How many hydrogen bond donor counts does 1-Acetylpyrrolidine-2-ethanol have?
It has 1 hydrogen bond donor count.
What is the exact mass of 1-Acetylpyrrolidine-2-ethanol?
The exact mass is 157.110278721 g/mol.
How many rotatable bond counts does 1-Acetylpyrrolidine-2-ethanol have?
It has 2 rotatable bond counts.
Is 1-Acetylpyrrolidine-2-ethanol a canonicalized compound?
Yes, it is a canonicalized compound according to PubChem.
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