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Structure

N-Methyl-1-pyridin-2-ylpropan-1-amine

CAS
959238-83-6
Catalog Number
ACM959238836
Category
Other Products
Molecular Weight
150.220860 [g/mol]
Molecular Formula
C9H14N2

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Specification

Synonyms
N-METHYL-1-PYRIDIN-2-YLPROPAN-1-AMINE, 959238-83-6, Ambcb4025878, SureCN2323123, CTK5H8370, MolPort-011-914-260, AKOS010037325, AG-H-94404
IUPAC Name
N-methyl-1-pyridin-2-ylpropan-1-amine
Canonical SMILES
CCC(C1=CC=CC=N1)NC
InChI Key
PZDVEUZUKAGTFJ-UHFFFAOYSA-N
Boiling Point
208.3ºC at 760 mmHg
Flash Point
79.8ºC
Density
0.95g/cm³
Exact Mass
150.11600
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of the compound?

The molecular formula is C9H14N2.

What is the molecular weight of the compound?

The molecular weight is 150.22 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is N-methyl-1-pyridin-2-ylpropan-1-amine.

What is the InChI of the compound?

The InChI is InChI=1S/C9H14N2/c1-3-8(10-2)9-6-4-5-7-11-9/h4-8,10H,3H2,1-2H3.

What is the InChIKey of the compound?

The InChIKey is PZDVEUZUKAGTFJ-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is CCC(C1=CC=CC=N1)NC.

What is the CAS number of the compound?

The CAS number is 959238-83-6.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 1.2.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

How many rotatable bond counts does the compound have?

The compound has 3 rotatable bond counts.

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