Acetonitrile-d3

CAT: 0024-sc-257059Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-257059Size:5 g

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CAS Number

2206-26-0

Chemical Information

(2H3)Acetonitrile

Acetonitrile-d3 is a deuterated compound. It has a role as a NMR solvent.

CAS Number	2206-26-0
PubChem CID	123151
IUPAC Name	2,2,2-trideuterioacetonitrile
Molecular Formula	C2H3N
Molecular Weight	44.07
XLogP	0
Topological Polar Surface Area	23.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	3
Formal Charge	0
Complexity	29

SMILES

[2H]C([2H])([2H])C#N

InChI

InChI=1S/C2H3N/c1-2-3/h1H3/i1D3

InChIKey

WEVYAHXRMPXWCK-FIBGUPNXSA-N

Chemical Structure

2D Structure

CAS: 2206-26-0

CID: 123151

Formula: C2H3N

MW: 44.07

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	44.07
XLogP3	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	44.045379338
Monoisotopic Mass	44.045379338
Topological Polar Surface Area	23.8 Å²
Heavy Atom Count	3
Formal Charge	0
Complexity	29.3
Isotope Atom Count	3
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

Catalog	Name
sc-207252	Acetonitrile
sc-228597	(Methylsulfonyl) acetonitrile
sc-257923	Nivalenol in acetonitrile
sc-239786	(Dimethylamino) acetonitrile
sc-227199	Acetonitrile-15N
sc-235217	(Formyloxy) acetonitrile
sc-326829	(Diisopropylamino) acetonitrile
sc-251386	(Triphenylphosphoranylidene) acetonitrile
sc-227198	Acetonitrile-13C2
sc-326829A	(Diisopropylamino) acetonitrile

Catalog	Name
CS-T-46997	Acetonitrile-d3
CS-T-46997-10mL	Acetonitrile D3
TRC-A163897-1G	Acetonitrile-13C2, d3
CS-T-103278	Acetonitrile-13C2-d3
CS-O-64121	Acetonitrile-d3-10ml
CS-O-64123	Acetonitrile-d3-50ml
CS-O-64122	Acetonitrile-d3-25ml
CS-O-64120	Acetonitrile-d3-5ml
CS-O-64119	Acetonitrile-d3-0.6 ampule
TRC-KIT6940-1X1ML	Phendimetrazine-d3 (1mg/ml in Acetonitrile)