Products for Research Use Only

Sodium tert-butoxide

CAT: 0862-GE4325-250gSize: 250 gDry Ice: NoHazardous: Yes
Product image 1
1 / 1
CAT#:0862-GE4325-250gSize:250 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
865-48-5
EC Number
212-741-9
UN Code
3206
MDL Number
MFCD00040575
HS Code
29051900
Purity
97.00%
Molecular Formula
C4H9NaO
Molecular Weight
96.11
Storage Conditions
+20°C
Hazardous Class
True

Chemical Information

Sodium tert-butoxide
CAS Number865-48-5
PubChem CID45051916
Molecular FormulaC4H10NaO
Molecular Weight97.11
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count6
Formal Charge0
Complexity25
SMILES
CC(C)(C)O.[Na]
InChI
InChI=1S/C4H10O.Na/c1-4(2,3)5;/h5H,1-3H3;
InChIKey
GSVQWRYRPRJOIM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sodium tert-butoxide
CAS: 865-48-5
CID: 45051916
Formula: C4H10NaO
MW: 97.11
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight97.11
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass97.06293422
Monoisotopic Mass97.06293422
Topological Polar Surface Area20.2 Ų
Heavy Atom Count6
Formal Charge0
Complexity25.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes