Products for Research Use Only

Acetone-d6 + 1% TMS 99.5%

CAT: 0286-A04445-01Size: 5 gDry Ice: NoHazardous: Yes
Product image 1
1 / 1
CAT#:0286-A04445-01Size:5 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
666-52-4
UN Code
UN1090
Pictogram
02 - Flammable; 07 - Irritant
UDF Signal Word
Danger
MDL Number
MFCD00044635
Hazard Statement
H225 Highly flammable liquid and vapor; H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
Other Statements
EUH066 Repeated exposure may cause skin dryness or cracking
DOT Name
Acetone
DOT Classification
Class 3
Packaging Group
PGII
Precautions
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking; P240 Ground/bond container and receiving equipment; P241 Use explosion-proof electrical/ventilating/lighting/[ ]/equipment; P260 Do not breathe dust/fume/gas/mist/vapors/spray; P264 Wash skin thoroughly after handling; P271 Use only outdoors or in a well-ventilated area; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P403+P235 Store in a well-ventilated place. Keep cool.

Chemical Information

Acetone-D6

Acetone d6 is a deuterated compound that is acetone in which all six hydrogen atoms are replaced by deuterium. It has a role as a NMR solvent and a polar aprotic solvent. It is a member of propanones and a deuterated compound.

CAS Number666-52-4
PubChem CID522220
IUPAC Name1,1,1,3,3,3-hexadeuteriopropan-2-one
Molecular FormulaC3H6O
Molecular Weight64.12
XLogP-0.1
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count4
Formal Charge0
Complexity26
SMILES
[2H]C([2H])([2H])C(=O)C([2H])([2H])[2H]
InChI
InChI=1S/C3H6O/c1-3(2)4/h1-2H3/i1D3,2D3
InChIKey
CSCPPACGZOOCGX-WFGJKAKNSA-N
Chemical Structure
2D Structure
2D structure of Acetone-D6
CAS: 666-52-4
CID: 522220
Formula: C3H6O
MW: 64.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight64.12
XLogP3-0.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass64.079525286
Monoisotopic Mass64.079525286
Topological Polar Surface Area17.1 Ų
Heavy Atom Count4
Formal Charge0
Complexity26.3
Isotope Atom Count6
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes