CAS 558-37-2|3,3-dimethylbut-1-ene|3,3-dimethyl-1-butene|3,3-dimethylbut-1-ene|tert-BUTYLETHYLENE|新己烯|Neohexene|3,3-二甲基-1-丁烯|3,3-Dimethyl-1-butene|tert-Butylethylene|3,3-二甲基-1-丁烯, 95%, ...

InChI=1S/C6H12/c1-5-6(2,3)4/h5H,1H2,2-4H3

PKXHXOTZMFCXSH-UHFFFAOYSA-N

H Acceptors

H Donor

LogD (pH = 5.5)

2.5250788

LogD (pH = 7.4)

2.5250788

Log P

2.5250788

Molar Refractivity

29.274

Polarizability

11.603333

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

3,3-dimethylbut-1-enetert-BUTYLETHYLENE新己烯Neohexene3,3-二甲基-1-丁烯3,3-Dimethyl-1-butenetert-Butylethylene3,3-二甲基-1-丁烯, 95%, stab. with 50-100ppm BHT

IUPAC Traditional name

3,3-dimethyl-1-butene

3,3-dimethylbut-1-ene

Click here to submit data

05209592

MP Biomedicals Rare Chemical collection

119059

Packaging
50, 250 mL in glass bottle

39832

Packaging
100 mL in glass bottle

Click here to submit data

Names and Identifiers

Synonyms

3,3-dimethylbut-1-enetert-BUTYLETHYLENE新己烯Neohexene3,3-二甲基-1-丁烯3,3-Dimethyl-1-butenetert-Butylethylene3,3-二甲基-1-丁烯, 95%, stab. with 50-100ppm BHT

IUPAC Traditional name

3,3-dimethyl-1-butene

IUPAC name

3,3-dimethylbut-1-ene

Registration numbers

CAS Number

558-37-2

MDL Number

MFCD00008853

Beilstein Number

1697101

PubChem SID

248647392484738316207279924864737

EC Number

PubChem CID

Molecule Details

MP Biomedicals Rare Chemical collection

Sigma Aldrich

119059

Packaging
50, 250 mL in glass bottle

39832

Packaging
100 mL in glass bottle

References

PubChem Literature

No Data Available

Click here to submit data

Bioactivity

PubChem BioAssay

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

Respiratory sensitization, category 1

Germ cell mutagenicity, categories 1A,1B,2

Carcinogenicity, categories 1A,1B,2

Reproductive toxicity, categories 1A,1B,2

Specific Target Organ Toxicity – Single exposure, categories 1,2

Specific Target Organ Toxicity – Repeated exposure, categories 1,2

Aspiration Hazard, category 1

Personal Protective Equipment

Eyeshields, Gloves

Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US)

GHS Precautionary statements

P210-P261-P301+P310-P305+P351+P338-P331

P210-P241-P301+P310-P303+P361+P353-P405-P501A

Hazard Class

European Hazard Symbols

Flammable (F)

Harmful (Xn)

Harmful (X)

GHS Signal Word

Danger

RID/ADR

UN 3295 3/PG 2

Risk Statements

11-36/37/38-65

11-65

Packing Group

GHS Hazard statements

H225-H304-H315-H319-H335

H225-H304

UN Number

3295

UN3295

Safety Statements

16-26-33-36-62

9-16-29-33-62

German water hazard class

TSCA Listed

是

Boiling Point

41 °C(lit.)

40-41°C

Density

0.653 g/mL at 25 °C(lit.)

0.653

Melting Point

-115 °C(lit.)

-115°C

Molecule

ID:85683