n-Hexane-d14, for NMR, +99.5% atom D, Thermo Scientific Chemicals

Product Code	Brand	Quantity	Packaging
10216340	Thermo Scientific Acros 244010010	1 g	Glass Bottle
10472811	Thermo Scientific Acros 244010050	5 g	Glass Bottle

Description

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

For NMR

Chemical Identifiers

• CAS: 21666-38-6
• Molecular Weight (g/mol): 100.26
• InChI Key: VLKZOEOYAKHREP-ZLKPZJALSA-N
• PubChem CID: 140854
• SMILES: [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]

• Molecular Formula: C6H14
• MDL Number: MFCD00037562
• Synonym: hexane-d14, tetradecadeuterohexane, n-hexane-d 14, 2h14 hexane, 2 h?? hexane, hexane-d14, 99 atom % d
• IUPAC Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecadeuteriohexane

Specifications

• Physical Form: Liquid
• Density: 0.9600g/mL
• CAS: 21666-38-6
• Linear Formula: D₃C(CD₂)₄CD₃
• Synonym: hexane-d14, tetradecadeuterohexane, n-hexane-d 14, 2h14 hexane, 2 h?? hexane, hexane-d14, 99 atom % d
• SMILES: [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]
• Molecular Weight (g/mol): 100.26
• Formula Weight: 100.28
• Chemical Name or Material: n-Hexane-d14, 99.5+ atom % D

• Color: Colorless
• Deuterium (D): 99.50% min.
• Molecular Formula: C6H14
• MDL Number: MFCD00037562
• InChI Key: VLKZOEOYAKHREP-ZLKPZJALSA-N
• IUPAC Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecadeuteriohexane
• PubChem CID: 140854
• Grade: NMR

Safety and Handling

GHS H Statement
Causes skin irritation. Toxic to aquatic life with long lasting effects. May be fatal if swallowed and enters airways. May cause drowsiness or dizziness. May cause damage to organs through prolonged or repeated exposure. Suspected of damaging fertility. Highly flammable liquid and vapor.

GHS P Statement
Use personal protective equipment as required. Avoid breathing dust/fume/gas/mist/vapors/spray. Do not breathe dust/fume/gas/mist/vapors/spray. IF SWALLOWED: Immediately call a POISON CENTRE or doctor/physician. Do NOT induce vomiting. Avoid release to the environment. IF ON SKIN: Wash with plenty of soap and water. Keep away from heat/sparks/open flames/hot surfaces. - No smoking. Ground/Bond container and receiving equipment.

Danger

Product Identifier

• n-Hexane-d14

Signal Word

• Danger

Hazard Category

• LONG-TERM AQUATIC HAZARD Chronic 2
• Aspiration toxicity Category 1
• Flammable liquid Category 2
• Reproductive toxicity Category 2
• Skin corrosion/irritation Category 2
• Specific target organ toxicity after repeated exposure Category 2
• Specific target organ toxicity Category 3

Hazard Statement

• H304-May be fatal if swallowed and enters airways.
• H315-Causes skin irritation.
• H361f-Suspected of damaging fertility.
• H373-May cause damage to organs.
• H411-Toxic to aquatic life with long lasting effects.
• H336-May cause drowsiness or dizziness.
• H225-Highly flammable liquid and vapour.

Precautionary Statement

• P210-Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.
• P240-Ground/bond container and receiving equipment.
• P260-Do not breathe dust/fume/gas/mist/vapours/spray.
• P261-Avoid breathing dust/fume/gas/mist/vapours/spray.
• P273-Avoid release to the environment.
• P280-Wear protective gloves/protective clothing/eye protection/face protection.
• P301+P310-IF SWALLOWED: Immediately call a POISON CENTER/doctor /
• P302+P352-IF ON SKIN: Wash with plenty of water/.
• P331-Do NOT induce vomiting.

RUO – Research Use Only