Basic information
- CAS
592-77-8- Standard SMILES
CC=CCCCC- InChIKey
OTTZHAVKAVGASB-UHFFFAOYSA-N- Molecular formula
- C7H14
- Average molar mass
- 98.19 g/mol
- Monoisotopic mass
- 98.10955045
Overview
2-heptene has been reported in Basella alba and Foeniculum vulgare with data available.
Names & identifiers
- Preferred name
- 2-Heptene
- IUPAC
- hept-2-ene
- English name
- trans-2-Heptene
- Molecular formula
- C7H14
- Molecular weight
- 98.19
Names & synonyms
Hept-2-ene2-HEPTENEheptene-22-C7H14UNII-ECH654N3COECH654N3CODTXSID0074718EINECS 209-768-3n2HepteneHept2eneHeptene2RefChem:87252
Show more names
2-HEPTENE 99%2-Heptene (c,t)TRANS-HEPTENE-2trans-2-HepteneHEPTENE(TRANS-2-)Heptene-2 (mixed isomers)
Heptene2 (cis, trans)DTXCID10425742Heptene (cis and trans mixture)2-HEPTENE (CIS-AND TRANS-MIXTURE)OTTZHAVKAVGASB-UHFFFAOYSA-N592-77-82-HEPTENE,CISSCHEMBL21160
Database identifiers
- CAS
592-77-8- PubChem CID
- 11611
- DTXSID
DTXSID0074718- EC Number
- 209-768-3
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 44
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Aliphatics, Unsaturated
SpringerMaterials PropertiesDensity
Vapor Pressure48.4 [mmHg]
Physical DescriptionClear colorless liquid; [MSDSonline]
Physicochemical properties
- Melting point
- -124.4 °C · -124.4°C (estimate)
- Boiling point
- 98 °C · 98 °C
- Density
- 0.71 · 0.71
- vapor pressure
- 88 mm · 88 mm Hg ( 37.7 °C)
- refractive index
- 1.41 · 1.41
- Flash point
- -1 °C · -1 °C
- form
- clear liquid
- color
- Colorless to Almost colorless
- Water Solubility
- 15 mg/L · 15mg/L(25 ºC)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazards SummaryAn irritant; [MSDSonline]
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
Toxicology
Adverse EffectsNeurotoxin - Acute solvent syndrome
Safety data
- wgk
- 3
- ridadr
- UN 3295 3/PG 2
- hs_code
- 2901.29.1010
- risk_code
- 11-36/37/38-65
- Signal word
- Danger
- Symbol(GHS)
- GHS02
- hazard_code
- F,Xn
- safety_code
- 16-26-36-62
- hazard_class
- 3
- packing_group
- II
- Hazard statements
- H225
- Precautionary statements
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers26 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
河南闰霖化工有限公司+86-18738066252; +86-18738066252 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
山东洛克化工有限公司17653113209 13065062079 · [email protected]
南通合润生物科技有限公司18362409333 · [email protected]
Dalian Ruiying Technology Co., Ltd.+86-0411-86907150 +86-15940963210 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
Related reactions
1 records
Compound notes
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