1- (Pyrazin-2-yl) ethanamine

CAT: 0127-OR1006257-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1006257-01Size:250 mg

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CAS Number

179323-60-5

Purity

95%

Smiles

NC(C)C1=NC=CN=C1

Chemical Information

1-(Pyrazin-2-yl)ethanamine

CAS Number	179323-60-5
PubChem CID	18519006
IUPAC Name	1-pyrazin-2-ylethanamine
Molecular Formula	C6H9N3
Molecular Weight	123.16
XLogP	-0.9
Topological Polar Surface Area	51.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	84

SMILES

CC(C1=NC=CN=C1)N

InChI

InChI=1S/C6H9N3/c1-5(7)6-4-8-2-3-9-6/h2-5H,7H2,1H3

InChIKey

IIGXIHLJMZQHJY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 179323-60-5

CID: 18519006

Formula: C6H9N3

MW: 123.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	123.16
XLogP3	-0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	123.079647300
Monoisotopic Mass	123.079647300
Topological Polar Surface Area	51.8 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	84.4
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
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PC911215-01	2,2,2-Trifluoro-1- (pyridin-2-yl) ethanamine
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