Basic information
- Standard SMILES
C=CC(=C)CC- InChIKey
IGLWCQMNTGCUBB-UHFFFAOYSA-N- Molecular formula
- C6H10
- Average molar mass
- 82.14 g/mol
- Monoisotopic mass
- 82.07825032
Names & identifiers
- Preferred name
- 3-Methylene-1-pentene
- IUPAC
- 3-methylidenepent-1-ene
- English name
- 2-Ethyl-1,3-butadiene
- Molecular formula
- C6H10
- Molecular weight
- 82.14
Names & synonyms
3404-63-51,3-BUTADIENE, 2-ETHYL-DTXSID401876473-methylene-1-penteneRefChem:1068299DTXCID001101382-Ethyl-1,3-butadiene3-methylidenepent-1-ene1-Pentene, 3-methylene-C2H5C(=CH2)CH=CH21-Pentene, 3-methylene-, homopolymer2-Ethylbutadiene
Show more names
2-Vinyl-1-butene2-ethyl-3-butadiene3-methylene-1-penten2-ethylbuta-1,3-diene1-pentene,3-methylene-
28350-22-3BRN 1731547SCHEMBL938094-01-00-01022 (Beilstein Handbook Reference)SCHEMBL833654SCHEMBL834536SCHEMBL835015SCHEMBL5685083
Database identifiers
- CAS
3404-63-5- PubChem CID
- 18850
- DTXSID
DTXSID40187647- Nikkaji
- J42.784E
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 60.4
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -94.9 °C · -94.9°C (estimate)
- Boiling point
- 72.85 °C · 72.85°C
- Density
- 0.712 · 0.7120
- refractive index
- 1.442 · 1.4420
- Henry's Law Constant
- 7.4 · 7.4×10-5 mol/(m3Pa) at 25℃, Yaws (2003)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers2 total
Alfa Chemistry1-516-6625404 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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