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Structure

4-(2-Aminoethyl)-1-methylpiperidin-4-ol

CAS
959237-87-7
Catalog Number
ACM959237877
Category
Other Products
Molecular Weight
158.241320 [g/mol]
Molecular Formula
C8H18N2O

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Specification

Synonyms
959237-87-7, SureCN383477, Ambcb4018196, CTK5H8357, MolPort-016-583-151, AKOS006280320, AG-H-94388, MCULE-9820115929, AB1009041, 4-(2-AMINOETHYL)-1-METHYLPIPERIDIN-4-OL
IUPAC Name
4-(2-aminoethyl)-1-methylpiperidin-4-ol
Canonical SMILES
CN1CCC(CC1)(CCN)O
InChI Key
DXBAGIYZNRUVOM-UHFFFAOYSA-N
Boiling Point
272ºC at 760 mmHg
Flash Point
118.3ºC
Density
1.026g/cm³
Exact Mass
158.14200
H-Bond Acceptor
3
H-Bond Donor
2
What is the molecular formula of the compound?

The molecular formula of the compound is C8H18N2O.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 4-(2-aminoethyl)-1-methylpiperidin-4-ol.

What is the molecular weight of the compound?

The molecular weight of the compound is 158.24 g/mol.

What is the InChIKey of the compound?

The InChIKey of the compound is DXBAGIYZNRUVOM-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

The compound has 2 hydrogen bond donor counts.

What is the exact mass of the compound?

The exact mass of the compound is 158.141913202 g/mol.

How many heavy atoms does the compound contain?

The compound contains 11 heavy atoms.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 49.5 Ų.

What is the complexity of the compound?

The complexity of the compound is 119.

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