Cas no 1119-65-9 (2-Heptyne)
2-Heptyne structure
Product Name:2-Heptyne
CAS No:1119-65-9
MF:C7H12
MW:96.1701822280884
MDL:MFCD00039970
CID:83395
PubChem ID:87570831
Update Time:2025-04-18
2-Heptyne Chemical and Physical Properties
Names and Identifiers
-
- 2-Heptyne
- hept-2-yne
- 1-Methyl-2-butylacetylene
- Butylmethylacetylene
- Methyl-butyl-acetylen
- n-Butylmethylacetylene
- DTXSID90149770
- H0431
- CS-0204679
- InChI=1/C7H12/c1-3-5-7-6-4-2/h3,5,7H2,1-2H
- FT-0612490
- 2-(5,5-Dimethyl-1,2,3-dioxaborinan-2-yl)benzoic acid ethyl ester
- n-C4H9C.$.CCH3
- 2-Heptyne, 98%
- NSC 63874
- NSC63874
- D90868
- EINECS 214-285-6
- NS00045255
- NSC-63874
- AKOS015841151
- 1119-65-9
- J-002677
- MFCD00039970
- DTXCID6072261
- 214-285-6
-
- MDL： MFCD00039970
- Inchi： 1S/C7H12/c1-3-5-7-6-4-2/h3,5,7H2,1-2H3
- InChI Key： AMSFEMSYKQQCHL-UHFFFAOYSA-N
- SMILES： C(CC#CC)CC
- BRN： 1733563
Computed Properties
- Exact Mass: 96.09390
- Monoisotopic Mass: 96.094
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 78.7
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 0A^2
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.9
Experimental Properties
- Color/Form: Not determined
- Density: 0.745?g/mL?at 25?°C(lit.)
- Melting Point: 11.29°C
- Boiling Point: 110°C
- Flash Point: 52?°F
- Refractive Index: n20/D 1.423(lit.)
- PSA: 0.00000
- LogP: 2.19990
- Solubility: Not determined
2-Heptyne Security Information
-
Symbol:
- Prompt：dangerous
- Hazard Statement： H225-H304
- Warning Statement： P210-P233-P240-P241+P242+P243-P280-P301+P310+P331-P303+P361+P353-P370+P378-P403+P235-P405-P501
- Hazardous Material transportation number：UN 3295 3/PG 1
- WGK Germany：3
- Hazard Category Code： 11-36/37/38
- Safety Instruction： S16-S26
-
Hazardous Material Identification：
- HazardClass：3
- PackingGroup：II
- Safety Term：3
- Packing Group：II
- Risk Phrases：R11; R65
2-Heptyne Customs Data
- HS CODE：2901299090
- Customs Data：
China Customs Code:
2901299090Overview:
2901299090 Other unsaturated acyclic hydrocarbons.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:2.0%.general tariff:30.0%
Declaration elements:
Product Name, component content, use to, The volume of packaging container used as gaseous fuel shall be reported, Bulk cargo shall be reported
Summary:
2901299090 unsaturated acyclic hydrocarbons.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:2.0%.General tariff:30.0%
2-Heptyne Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 009261-1g |
2-Heptyne |
1119-65-9 | 98% | 1g |
￡10.00 | 2022-03-01 | |
| Fluorochem | 009261-5ml |
2-Heptyne |
1119-65-9 | 98% | 5ml |
￡37.00 | 2022-03-01 | |
| A FA AI SHA ， SAI MO FEI SHI ER KE JI QI XIA GONG SI | B21528-2g |
2-Heptyne, 98+% |
1119-65-9 | 98+% | 2g |
￥535.00 | 2023-04-13 | |
| A FA AI SHA ， SAI MO FEI SHI ER KE JI QI XIA GONG SI | B21528-10g |
2-Heptyne, 98+% |
1119-65-9 | 98+% | 10g |
￥1490.00 | 2023-04-13 | |
| A FA AI SHA ， SAI MO FEI SHI ER KE JI QI XIA GONG SI | B21528-50g |
2-Heptyne, 98+% |
1119-65-9 | 98+% | 50g |
￥6704.00 | 2023-04-13 | |
| TRC | H998583-50mg |
2-Heptyne |
1119-65-9 | 50mg |
$ 50.00 | 2022-06-04 | ||
| TRC | H998583-100mg |
2-Heptyne |
1119-65-9 | 100mg |
$ 65.00 | 2022-06-04 | ||
| TRC | H998583-500mg |
2-Heptyne |
1119-65-9 | 500mg |
$ 80.00 | 2022-06-04 | ||
| abcr | AB131526-5 ml |
2-Heptyne, 98%; . |
1119-65-9 | 98% | 5 ml |
€167.50 | 2024-04-20 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | H862196-5ml |
2-Heptyne |
1119-65-9 | ≥99%(GC) | 5ml |
598.00 | 2021-05-17 |
2-Heptyne Related Literature
-
Juan Pablo Martínez,María Vizuete,Luis M. Arellano,Albert Poater,F. Matthias Bickelhaupt,Fernando Langa,Miquel Solà Nanoscale 2018 10 15078
-
L. Crombie,S. H. Harper,F. C. Newman,D. Thompson,R. J. D. Smith J. Chem. Soc. 1956 126
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3. Observation of slowed rotation about the η6-arene–chromium bond in the tripodal chromium complexes of the trimers of bicyclo[2.2.1]hept-2-yne: intramolecular rotational barriers in organometallic complexes and their correlation with internal non-bonding interactions and structural changesGeoffrey Hunter,Regina Louise MacKay,Peter Kremminger,Walter Weissensteiner J. Chem. Soc. Dalton Trans. 1991 3349
-
4. Photolysis of 1,1,1-triarylalk-2-enes and 1,1,1-triarylhept-2-ynes. A novel generation of aryl(alk-1-enyl)carbenes and aryl(alk-1-ynyl)carbenesMin Shi,Kouji Shouki,Yoshiki Okamoto,Setsuo Takamuku J. Chem. Soc. Perkin Trans. 1 1990 2443
-
5. 931. Researches on acetylenic compounds. Part LVIII. The structure of an anomalous Reppe carboxylation productP. J. Ashworth,G. H. Whitham,M. C. Whiting J. Chem. Soc. 1957 4633
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