Products for Research Use Only

1-Methylpyrrolidine-d8

CAT: 0572-TRC-M326211-10MGSize: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-M326211-10MGSize:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
131857-29-9
Synonyms
N-Methylpyrrolidine-d8; N-Methyltetrahydropyrrole-d8; NSC 65579-d8; N-Methylpyrrolidine-2,2,3,3,4,4,5,5-d8
Hazard Statement
No Data Available
Smiles
[2H]C1([2H])N(C)C([2H])([2H])C([2H])([2H])C1([2H])[2H]
Molecular Formula
C5H3D8N
Molecular Weight
93.2
Shipping Conditions
Room Temperature

Chemical Information

1-Methylpyrrolidine-2,2,3,3,4,4,5,5-d8
CAS Number131857-29-9
PubChem CID12227860
IUPAC Name2,2,3,3,4,4,5,5-octadeuterio-1-methylpyrrolidine
Molecular FormulaC5H11N
Molecular Weight93.20
XLogP0.9
Topological Polar Surface Area3.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count6
Formal Charge0
Complexity37
SMILES
[2H]C1(C(C(N(C1([2H])[2H])C)([2H])[2H])([2H])[2H])[2H]
InChI
InChI=1S/C5H11N/c1-6-4-2-3-5-6/h2-5H2,1H3/i2D2,3D2,4D2,5D2
InChIKey
AVFZOVWCLRSYKC-UDCOFZOWSA-N
Chemical Structure
2D Structure
2D structure of 1-Methylpyrrolidine-2,2,3,3,4,4,5,5-d8
CAS: 131857-29-9
CID: 12227860
Formula: C5H11N
MW: 93.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight93.20
XLogP30.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass93.139363323
Monoisotopic Mass93.139363323
Topological Polar Surface Area3.2 Ų
Heavy Atom Count6
Formal Charge0
Complexity37.2
Isotope Atom Count8
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Popular Products