CAS 89797-68-2|5-(Ethylthio)-1H-tetrazole|5-(ethylsulfanyl)-4H-1,2,3,4-tetrazole|5-(ethylsulfanyl)-1H-1,2,3,4-tetrazole|5-(ethylsulfanyl)-1H-1,2,3,4-tetrazole|5-(Ethylthio)tetrazole solution|5-(乙硫...

InChI=1S/C3H6N4S/c1-2-8-3-4-6-7-5-3/h2H2,1H3,(H,4,5,6,7)

GONFBOIJNUKKST-UHFFFAOYSA-N

Acid pKa

3.4031894

H Acceptors

H Donor

LogD (pH = 5.5)

-0.6977065

LogD (pH = 7.4)

-0.8154689

Log P

0.7945328

Molar Refractivity

35.3486

Polarizability

12.211282

Polar Surface Area

54.46

Rotatable Bonds

Lipinski's Rule of Five

true

5-(Ethylthio)-1H-tetrazole5-(Ethylthio)tetrazole solution5-(乙硫基)-1H-四唑5-(Ethylthio)-1H-tetrazole5-(乙硫基)-1H-四唑5-Ethylthio-1H-tetrazole5-(Ethylthio)-1H-tetrazole

IUPAC Traditional name

5-(ethylsulfanyl)-4H-1,2,3,4-tetrazole 5-(ethylsulfanyl)-1H-1,2,3,4-tetrazole

5-(ethylsulfanyl)-1H-1,2,3,4-tetrazole

false

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634573

Packaging
2, 4×2 L in Sure/Seal™
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493805

Packaging
2 g in glass bottle

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Names and Identifiers

Synonyms

5-(Ethylthio)-1H-tetrazole5-(Ethylthio)tetrazole solution5-(乙硫基)-1H-四唑5-(Ethylthio)-1H-tetrazole5-(乙硫基)-1H-四唑5-Ethylthio-1H-tetrazole5-(Ethylthio)-1H-tetrazole

IUPAC Traditional name

5-(ethylsulfanyl)-4H-1,2,3,4-tetrazole 5-(ethylsulfanyl)-1H-1,2,3,4-tetrazole

IUPAC name

5-(ethylsulfanyl)-1H-1,2,3,4-tetrazole

Registration numbers

PubChem CID

2758928

PubChem SID

1609716792488263324872861

MDL Number

MFCD00068733

CAS Number

89797-68-2

Molecule Details

Sigma Aldrich

634573

Packaging
2, 4×2 L in Sure/Seal™
View returnable container options.

493805

Packaging
2 g in glass bottle

References

PubChem Literature

No Data Available

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Bioactivity

PubChem BioAssay

Storage Warning

Irritant

RID/ADR

UN 1648 3/PG 2

Risk Statements

11-20/21/22-36-44

11-20/21/22-36

5-36/37/38-44

German water hazard class

European Hazard Symbols

Harmful (Xn)

Flammable (F)

Irritant (Xi)

Safety Statements

16-35-36/37

16-26-36/37

26-35

Hazard Class

Packing Group

UN Number

1648

GHS Pictograms

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

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

Personal Protective Equipment

Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

dust mask type N95 (US), Eyeshields, Gloves

GHS Hazard statements

H225-H302+H332-H319

H315-H319-H335

GHS Precautionary statements

P210-P305+P351+P338

P261-P305+P351+P338

GHS Signal Word

Danger

Warning

Storage Temperature

2-8°C

Supplemental Hazard Statements

Risk of explosion if heated under confinement.

Impurities

≤0.002% water

<0.002% water

≤30 ppm water content (Karl Fischer)

Packaging

pkg of 4 × 2.5 L L0302511-04

Type

for DNA synthesis

Empirical Formula (Hill Notation)

Molecule

ID:8372