CAS 1173019-13-0|二甲基-13C2 二硫|[(13C)methyldisulfanyl](13C)methane|Dimethyl-13C2 disulfide|[(13C)methyldisulfanyl](1<s...

Molecular Formula

C₂H₆S₂

Molecular Mass

96.18434968

Exact Mass

95.99780187

InChI

InChI=1S/C2H6S2/c1-3-4-2/h1-2H3/i1+1,2+1

InChIKey

WQOXQRCZOLPYPM-ZDOIIHCHSA-N

Canonic Smiles

[13CH3]SS[13CH3]

Isomeric Smiles

[13CH3]SS[13CH3]

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

1.3502556

LogD (pH = 7.4)

1.3502556

Log P

1.3502556

Molar Refractivity

27.1472

Polarizability

10.577469

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Commercial Catalog

Academic Data

Synonyms

二甲基-13C2 二硫Dimethyl-13C2 disulfide

IUPAC Traditional name

[(¹³C)methyldisulfanyl](¹³C)methane

IUPAC name

[(¹³C)methyldisulfanyl](¹³C)methane

MDL Number

CAS Number

PubChem CID

PubChem SID

Physical Property

Safety Information

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

Product Information

97% (CP)

99 atom % 13C

mol wt 96.17 by atom % calculation

13CH3SS13CH3

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Sigma Aldrich

708003

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

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Commercial Catalog

Academic Data

Synonyms

二甲基-13C2 二硫Dimethyl-13C2 disulfide

IUPAC Traditional name

[(¹³C)methyldisulfanyl](¹³C)methane

IUPAC name

[(¹³C)methyldisulfanyl](¹³C)methane

MDL Number

CAS Number

PubChem CID

PubChem SID

708003

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

No Data Available

Click here to submit data

Physical Property

Safety Information

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

Product Information

97% (CP)

99 atom % 13C

mol wt 96.17 by atom % calculation

13CH3SS13CH3

Acute toxicity (oral, dermal, inhalation), category 4

Skin irritation, category 2

Eye irritation, category 2

Skin sensitisation, category 1

Specific Target Organ Toxicity – Single exposure, category 3

RID/ADR

UN 2381 3/PG 2

Risk Statements

11-20/22-36-51/53

GHS Signal Word

Danger

Packing Group

UN Number

2381

European Hazard Symbols

Flammable (F)

Harmful (Xn)

Nature polluting (N)

GHS Hazard statements

H225-H302+H332-H319

MSDS Link

Download link

Safety Statements

26-61

Hazard Class

German water hazard class

GHS Precautionary statements

P210-P305+P351+P338

Molecule

ID:135863