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N-methylmethan-d3-amine

CAT: 1299-RG-E141702-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-E141702-01Size:10 mg
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CAS Number
20786-94-1
Synonyms
N-methylmethan-d3-amine
Molecular Formula
C2H4D3N
Molecular Weight
48.1

Chemical Information

Dimethyl-1,1,1-D3-amine

See also: Dimethylamine (annotation moved to); Dimethyl amidogen (annotation moved to).

CAS Number20786-94-1
PubChem CID12199019
IUPAC Name1,1,1-trideuterio-N-methylmethanamine
Molecular FormulaC2H7N
Molecular Weight48.10
XLogP-0.2
Topological Polar Surface Area12
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count3
Formal Charge0
Complexity2
SMILES
[2H]C([2H])([2H])NC
InChI
InChI=1S/C2H7N/c1-3-2/h3H,1-2H3/i1D3
InChIKey
ROSDSFDQCJNGOL-FIBGUPNXSA-N
Chemical Structure
2D Structure
2D structure of Dimethyl-1,1,1-D3-amine
CAS: 20786-94-1
CID: 12199019
Formula: C2H7N
MW: 48.10
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight48.10
XLogP3-0.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass48.076679465
Monoisotopic Mass48.076679465
Topological Polar Surface Area12 Ų
Heavy Atom Count3
Formal Charge0
Complexity2.8
Isotope Atom Count3
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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