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N-(Methyl-d3)-1-propanamine

CAT: 0572-TRC-M326306-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M326306-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
223459-65-2
Hazard Statement
No Data Available
Smiles
[2H]C([2H])([2H])NCCC
Molecular Formula
C4 D3 H8 N
Molecular Weight
76.155
InChI
InChI=1S/C4H11N/c1-3-4-5-2/h5H,3-4H2,1-2H3/i2D3
Additionnal Information
IUPAC name: N-(trideuteriomethyl)propan-1-amine
Shipping Conditions
Room Temperature

Chemical Information

N-(Methyl-d3)-1-propanamine
CAS Number223459-65-2
PubChem CID101230762
IUPAC NameN-(trideuteriomethyl)propan-1-amine
Molecular FormulaC4H11N
Molecular Weight76.16
XLogP0.8
Topological Polar Surface Area12
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count5
Formal Charge0
Complexity13
SMILES
[2H]C([2H])([2H])NCCC
InChI
InChI=1S/C4H11N/c1-3-4-5-2/h5H,3-4H2,1-2H3/i2D3
InChIKey
GVWISOJSERXQBM-BMSJAHLVSA-N
Chemical Structure
2D Structure
2D structure of N-(Methyl-d3)-1-propanamine
CAS: 223459-65-2
CID: 101230762
Formula: C4H11N
MW: 76.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight76.16
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass76.107979593
Monoisotopic Mass76.107979593
Topological Polar Surface Area12 Ų
Heavy Atom Count5
Formal Charge0
Complexity13.1
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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