CAS
912771-20-1 Purity
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912771-20-1 Purity
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2-Piperidin-3-yl-azepane
CAS
912771-29-0
Catalog Number
ACM912771290
Category
Other Products
Molecular Weight
182.31
Molecular Formula
C11H22N2
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Specification
Synonyms
2-PIPERIDIN-3-YL-AZEPANE;2-(3-Piperidino)hexamethyleneimine, tech. 90%;2-(3-Piperidinyl)hexamethyleneimine, tech. 90%;2-(3-Piperidinyl)hexamethyleneimine
IUPAC Name
2-piperidin-3-ylazepane
Canonical SMILES
C1CCC(NCC1)C2CCCNC2
InChI Key
NILYFVLXUNTUTG-UHFFFAOYSA-N
Boiling Point
268.3ºC at 760 mmHg
Flash Point
134ºC
Density
0.928g/cm³
Exact Mass
182.17800
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular formula of 2-Piperidin-3-yl-azepane?
The molecular formula of 2-Piperidin-3-yl-azepane is C11H22N2.
When was 2-Piperidin-3-yl-azepane created and last modified?
2-Piperidin-3-yl-azepane was created on 2007-10-02 and last modified on 2023-12-30.
What is the molecular weight of 2-Piperidin-3-yl-azepane?
The molecular weight of 2-Piperidin-3-yl-azepane is 182.31 g/mol.
What is the InChIKey of 2-Piperidin-3-yl-azepane?
The InChIKey of 2-Piperidin-3-yl-azepane is NILYFVLXUNTUTG-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 2-Piperidin-3-yl-azepane have?
2-Piperidin-3-yl-azepane has 2 hydrogen bond donor counts.
What is the rotatable bond count of 2-Piperidin-3-yl-azepane?
The rotatable bond count of 2-Piperidin-3-yl-azepane is 1.
What is the exact mass of 2-Piperidin-3-yl-azepane?
The exact mass of 2-Piperidin-3-yl-azepane is 182.178298710 g/mol.
How many defined atom stereocenter counts does 2-Piperidin-3-yl-azepane have?
2-Piperidin-3-yl-azepane has 0 defined atom stereocenter counts.
What is the topological polar surface area of 2-Piperidin-3-yl-azepane?
The topological polar surface area of 2-Piperidin-3-yl-azepane is 24.1 Ų.
Is 2-Piperidin-3-yl-azepane a canonicalized compound?
Yes, 2-Piperidin-3-yl-azepane is a canonicalized compound.
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