4-Methoxybut-1-ene
Basic information
- CAS
4696-30-4- Standard SMILES
C=CCCOC- InChIKey
VDTUJQCSPFYIKZ-UHFFFAOYSA-N- Molecular formula
- C5H10O
- Average molar mass
- 86.13 g/mol
- Monoisotopic mass
- 86.07316494
Names & identifiers
- Preferred name
- 4-Methoxybut-1-ene
- IUPAC
- 4-methoxybut-1-ene
Names & synonyms
4-methoxybut-1-ene4696-30-4DTXSID70312167RefChem:524750DTXCID20263291851-453-34-Methoxy-1-butene1-Methoxy-3-butene5-Oxahex-1-eneAKJ7JBY6WE1-Butene, 4-methoxy-Ether, 3-butenyl methyl
Show more names
NSC-250979MFCD22413896NSC2509791-Butene, 4-methoxymethyl-3-butenyl etherUNII-AKJ7JBY6WE3-Butenyl methyl ether #CH2=CHCH2CH2OCH3
Database identifiers
- CAS
4696-30-4- PubChem CID
- 317680
- DTXSID
DTXSID70312167- UNII
- AKJ7JBY6WE
- EC Number
- 851-453-3
- Nikkaji
- J2.729.216J
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 32.9
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, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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