CAS 7642-10-6|CAS 14686-14-7|CAS 592-78-9|hept-3-ene|3-HEPTENE|hept-3-ene|(3E)-hept-3-ene|trans-3-Heptene|反-3-庚烯|3-heptene (cis)|3-Heptene|3-庚烯|3-Heptene, cis + trans|3-庚烯, 顺式+反式

Molecular Formula

C₇H₁₄

Molecular Mass

98.18606

Exact Mass

98.10955045

InChI

InChI=1S/C7H14/c1-3-5-7-6-4-2/h5,7H,3-4,6H2,1-2H3

InChIKey

WZHKDGJSXCTSCK-UHFFFAOYSA-N

Canonic Smiles

CCC/C=C/CC

Isomeric Smiles

CCC/C=C/CC

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

3.213785

LogD (pH = 7.4)

3.213785

Log P

3.213785

Molar Refractivity

35.1258

Polarizability

13.44952

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

5357259

Synonyms

3-HEPTENE反-3-庚烯trans-3-Heptene3-Heptene3-庚烯3-Heptene, cis + trans3-庚烯, 顺式+反式

IUPAC Traditional name

hept-3-ene 3-heptene (cis)

IUPAC name

hept-3-ene (3E)-hept-3-ene

MDL Number

MFCD00009475

Beilstein Number

17190161719014

Product Information

Safety Information

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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

Physical Property

No Data Available

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No Data Available

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MP Biomedicals

05209452

MP Biomedicals Rare Chemical collection

Sigma Aldrich

51920

Packaging
5 mL in glass bottle

No Data Available

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Academic Data

PubChem

5357259

Synonyms

3-HEPTENE反-3-庚烯trans-3-Heptene3-Heptene3-庚烯3-Heptene, cis + trans3-庚烯, 顺式+反式

IUPAC Traditional name

hept-3-ene 3-heptene (cis)

IUPAC name

hept-3-ene (3E)-hept-3-ene

MDL Number

Beilstein Number

MP Biomedicals Rare Chemical collection

Sigma Aldrich

51920

Packaging
5 mL in glass bottle

No Data Available

Click here to submit data

Product Information

Safety Information

Download link

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

Physical Property

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

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

Hazard Class

GHS Hazard statements

H225-H304-H315-H319-H335

H225-H304

H225

Personal Protective Equipment

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

Safety Statements

16-26-36-62

16-62

Risk Statements

11-36/37/38-65

11-65

European Hazard Symbols

Flammable (F)

Harmful (Xn)

UN Number

3295

UN3295

Packing Group

German water hazard class

GHS Precautionary statements

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

P210-P301+P310-P331

P210-P241-P280-P303+P361+P353-P403+P235-P501A

GHS Signal Word

Danger

RID/ADR

UN 3295 3/PG 2

TSCA Listed

否

Density

0.698 g/mL at 25 °C(lit.)

0.702 g/mL at 20 °C(lit.)

Boiling Point

94 °C(lit.)

95-96 °C(lit.)

95-96°C

Molecule

ID:108991