1,1,1,4,4,4-hexadeuteriobutane

Modify Date: 2024-01-08 17:04:18

1,1,1,4,4,4-hexadeuteriobutane Structure
1,1,1,4,4,4-hexadeuteriobutane structure
Common Name 1,1,1,4,4,4-hexadeuteriobutane
CAS Number 13183-67-0 Molecular Weight 64.15920
Density 2.11 (vs air) Boiling Point -0.5ºC(lit.)
Molecular Formula C4H4D6 Melting Point -138ºC(lit.)
MSDS Chinese USA Flash Point N/A
Symbol GHS02 GHS04
GHS02, GHS04
Signal Word Danger

 Names

Name 1,1,1,4,4,4-hexadeuteriobutane
Synonym More Synonyms

 Chemical & Physical Properties

Density 2.11 (vs air)
Boiling Point -0.5ºC(lit.)
Melting Point -138ºC(lit.)
Molecular Formula C4H4D6
Molecular Weight 64.15920
Exact Mass 64.11590
LogP 1.80640
Vapour Pressure 1920mmHg at 25°C
Index of Refraction 1.354

 MSDS


Section1. IDENTIFICATION OF THE SUBSTANCE/MIXTURE
Product identifiers
Product name: Butane-1,1,1,4,4,4-d6
CAS-No.: 13183-67-0
Relevant identified uses of the substance or mixture and uses advised against
Identified uses: Laboratory chemicals, Manufacture of substances



Section2. HAZARDS IDENTIFICATION
Classification of the substance or mixture
Classification according to Regulation (EC) No 1272/2008 [EU-GHS/CLP]
Gases under pressure (Liquefied gas)
Classification according to EU Directives 67/548/EEC or 1999/45/EC
Extremely flammable.
Label elements
Labelling according Regulation (EC) No 1272/2008 [CLP]
Pictogram
Signal wordWarning
Hazard statement(s)
H280Contains gas under pressure; may explode if heated.
Precautionary statement(s)
P410 + P403Protect from sunlight. Store in a well-ventilated place.
Supplemental Hazardnone
Statements
According to European Directive 67/548/EEC as amended.
Hazard symbol(s)
R-phrase(s)
R12Extremely flammable.
S-phrase(s)
S16Keep away from sources of ignition - No smoking.
Other hazards - none

Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Substances
Formula: C4D6H4
Molecular Weight: 64,16 g/mol
ComponentConcentration
Butane-1,1,1,4,4,4-d6
CAS-No.13183-67-0-

Section4. FIRST AID MEASURES
Description of first aid measures
General advice
Consult a physician. Show this safety data sheet to the doctor in attendance.
If inhaled
If breathed in, move person into fresh air. If not breathing, give artificial respiration. Consult a physician.
In case of skin contact
Wash off with soap and plenty of water. Consult a physician.
In case of eye contact
Flush eyes with water as a precaution.
If swallowed
Do NOT induce vomiting. Never give anything by mouth to an unconscious person. Rinse mouth with water.
Consult a physician.
Most important symptoms and effects, both acute and delayed
narcosis, Dermatitis
Indication of any immediate medical attention and special treatment needed
no data available

Section5. FIRE-FIGHTING MEASURES
Extinguishing media
Suitable extinguishing media
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
Special hazards arising from the substance or mixture
no data available
Advice for firefighters
Wear self contained breathing apparatus for fire fighting if necessary.
Further information
Use water spray to cool unopened containers.

Section6. ACCIDENTAL RELEASE MEASURES
Personal precautions, protective equipment and emergency procedures
Avoid breathing vapors, mist or gas. Ensure adequate ventilation. Remove all sources of ignition. Evacuate
personnel to safe areas. Beware of vapours accumulating to form explosive concentrations. Vapours can
accumulate in low areas.
Environmental precautions
Prevent further leakage or spillage if safe to do so. Do not let product enter drains.
Methods and materials for containment and cleaning up
Clean up promptly by sweeping or vacuum.
Reference to other sections
For disposal see section 13.

Section7. HANDLING AND STORAGE
Precautions for safe handling
Avoid inhalation of vapour or mist.
Keep away from sources of ignition - No smoking.Take measures to prevent the build up of electrostatic
charge.
Conditions for safe storage, including any incompatibilities
Store in cool place. Keep container tightly closed in a dry and well-ventilated place.
Store under inert gas. hygroscopic
Specific end uses
no data available

Section8. EXPOSURE CONTROLS/PERSONAL PROTECTION
Control parameters
Components with workplace control parameters
Exposure controls
Appropriate engineering controls
Handle in accordance with good industrial hygiene and safety practice. Wash hands before breaks and at
the end of workday.
Personal protective equipment
Eye/face protection
Face shield and safety glasses Use equipment for eye protection tested and approved under
appropriate government standards such as NIOSH (US) or EN 166(EU).
Skin protection
Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique
(without touching glove's outer surface) to avoid skin contact with this product. Dispose of
contaminated gloves after use in accordance with applicable laws and good laboratory practices.
Wash and dry hands.
The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and the
standard EN 374 derived from it.
Body Protection
impervious clothing, Flame retardant antistatic protective clothing, The type of protective equipment
must be selected according to the concentration and amount of the dangerous substance at the
specific workplace.
Respiratory protection
Where risk assessment shows air-purifying respirators are appropriate use a full-face respirator with
multi-purpose combination (US) or type AXBEK (EN 14387) respirator cartridges as a backup to
engineering controls. If the respirator is the sole means of protection, use a full-face supplied air
respirator. Use respirators and components tested and approved under appropriate government
standards such as NIOSH (US) or CEN (EU).

Section9. PHYSICAL AND CHEMICAL PROPERTIES
Information on basic physical and chemical properties
a) AppearanceForm: Liquefied gas
b) Odourno data available
c) Odour Thresholdno data available
d) pHno data available
e) Melting point/freezingMelting point/range: -138 °C - lit.
point
f) Initial boiling point and -0,5 °C - lit.
boiling range
g) Flash pointno data available
h) Evaporation rateno data available
i) Flammability (solid, gas) no data available
j) Upper/lowerUpper explosion limit: 8,40 %(V)
flammability orLower explosion limit: 1,80 %(V)
explosive limits
k) Vapour pressure2.426 hPa at 25,00 °C
3.556,67 hPa at 37,70 °C
l) Vapour densityno data available
m) Relative densityno data available
n) Water solubilityno data available
o) Partition coefficient: n- log Pow: 2,890
octanol/water
p) Autoignitionno data available
temperature
q) Decompositionno data available
temperature
r) Viscosityno data available
s) Explosive propertiesno data available
t) Oxidizing propertiesno data available
Other safety information
no data available

Section10. STABILITY AND REACTIVITY
Reactivity
no data available
Chemical stability
no data available
Possibility of hazardous reactions
no data available
Conditions to avoid
Heat, flames and sparks. Extremes of temperature and direct sunlight.
Incompatible materials
Strong oxidizing agents
Hazardous decomposition products
no data available

Section11. TOXICOLOGICAL INFORMATION
Information on toxicological effects
Acute toxicity
no data available
LC50 Inhalation - rat - 4,00 h - 658.000 mg/m3
Skin corrosion/irritation
no data available
Serious eye damage/eye irritation
no data available
Respiratory or skin sensitization
no data available
Germ cell mutagenicity
no data available
Carcinogenicity
IARC:No component of this product present at levels greater than or equal to 0.1% is identified as
probable, possible or confirmed human carcinogen by IARC.
Reproductive toxicity
no data available
Specific target organ toxicity - single exposure
no data available
Specific target organ toxicity - repeated exposure
no data available
Aspiration hazard
no data available
Potential health effects
InhalationMay be harmful if inhaled. May cause respiratory tract irritation.
IngestionMay be harmful if swallowed.
SkinMay be harmful if absorbed through skin. May cause skin irritation.
EyesMay cause eye irritation.
Signs and Symptoms of Exposure
narcosis, Dermatitis
Additional Information
RTECS: Not available

Section12. ECOLOGICAL INFORMATION
Toxicity
no data available
Persistence and degradability
no data available
Bioaccumulative potential
no data available
Mobility in soil
no data available
Results of PBT and vPvB assessment
no data available
Other adverse effects
no data available

Section13. DISPOSAL CONSIDERATIONS
Waste treatment methods
Product
Burn in a chemical incinerator equipped with an afterburner and scrubber but exert extra care in igniting as
this material is highly flammable. Offer surplus and non-recyclable solutions to a licensed disposal
company.
Contaminated packaging
Dispose of as unused product.

Section14. TRANSPORT INFORMATION
UN number
ADR/RID: 2037IMDG: 2037IATA: 2037
UN proper shipping name
ADR/RID: RECEPTACLES, SMALL, CONTAINING GAS
IMDG:
IATA:
Transport hazard class(es)
ADR/RID: 2.2IMDG: 2.2IATA: 2.2
Packaging group
ADR/RID: -IMDG: -IATA: -
Environmental hazards
ADR/RID: noIMDG Marine pollutant: noIATA: no
Special precautions for user
no data available



SECTION 15 - REGULATORY INFORMATION
N/A


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Symbol GHS02 GHS04
GHS02, GHS04
Signal Word Danger
Hazard Statements H220-H280
Precautionary Statements P210-P377-P381-P410 + P403
Hazard Codes F: Flammable;Xi: Irritant;
Risk Phrases 11-36/37
Safety Phrases 16-26-33-38
RIDADR UN 1011 2.1

 Synonyms

Butane-1,1,1,4,4,4-d6
n-butane-1,1,1,4,4,4-d6
MFCD00190392
1,1,1,4,4,4-hexadeuterio-butane
1,1,1,4,4,4-Hexadeuterio-butan
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