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Structure

1-(6-Methylpyridin-3-yl)ethylamine

CAS
92295-43-7
Catalog Number
ACM92295437
Category
Other Products
Molecular Weight
136.19
Molecular Formula
C8H12N2

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Specification

Synonyms
1-(6-methylpyridin-3-yl)ethanamine, 92295-43-7, 1-(6-methyl-3-pyridinyl)ethanamine, 1-(6-METHYL-PYRIDIN-3-YL)-ETHYLAMINE, SureCN594622, Ambcb4014888, CTK5H1110, MolPort-008-421-278, RW2714, 1-(6-methylpyridin-3-yl)-ethylamine, AKOS012457499, AB53828, AG-H-78519, QC-8900, AK-70917, 1-(6-METHYL-3-PYRIDYL)ETHYLAMINE, A,6-DIMETHYL-3-PYRIDINEMETHANAMINE, KB-215565, 1-(6-METHYLPYRIDIN-3-YL)ETHAN-1-AMINE, 3-PYRIDINEMETHANAMINE, ALPHA,6-DIMETHYL-
IUPAC Name
1-(6-methylpyridin-3-yl)ethanamine
Canonical SMILES
CC1=NC=C(C=C1)C(C)N
InChI Key
GLTIIUKSLNSXKM-UHFFFAOYSA-N
Boiling Point
231.1ºC at 760 mmHg
Flash Point
114.2ºC
Density
1g/cm³
Exact Mass
136.10000
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of the compound?

The molecular formula of the compound is C8H12N2.

What is the molecular weight of the compound?

The molecular weight of the compound is 136.19 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 1-(6-methylpyridin-3-yl)ethanamine.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C8H12N2/c1-6-3-4-8(5-10-6)7(2)9/h3-5,7H,9H2,1-2H3.

What is the InChIKey of the compound?

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

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is CC1=NC=C(C=C1)C(C)N.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does the compound have?

The compound has 2 hydrogen bond acceptor counts.

How many rotatable bond counts does the compound have?

The compound has 1 rotatable bond count.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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