1H-1,2,3-Triazole

CAT: 0024-sc-254006BSize: 100 gDry Ice: NoHazardous: No

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CAT#:0024-sc-254006BSize:100 g

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CAS Number

288-36-8

Chemical Information

1H-1,2,3-Triazole

1H-1,2,3-triazole is a 1,2,3-triazole. It is a tautomer of a 2H-1,2,3-triazole and a 4H-1,2,3-triazole.

CAS Number	288-36-8
PubChem CID	67516
IUPAC Name	2H-triazole
Molecular Formula	C2H3N3
Molecular Weight	69.07
XLogP	-0.3
Topological Polar Surface Area	41.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	5
Formal Charge	0
Complexity	24

SMILES

C1=NNN=C1

InChI

InChI=1S/C2H3N3/c1-2-4-5-3-1/h1-2H,(H,3,4,5)

InChIKey

QWENRTYMTSOGBR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 288-36-8

CID: 67516

Formula: C2H3N3

MW: 69.07

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	69.07
XLogP3	-0.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	69.032697108
Monoisotopic Mass	69.032697108
Topological Polar Surface Area	41.6 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	24.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes