Basic information
- CAS
23186-70-1- Standard SMILES
C=CCOCCCCC- InChIKey
QHOPNDWHOHMZPV-UHFFFAOYSA-N- Molecular formula
- C8H16O
- Average molar mass
- 128.21 g/mol
- Monoisotopic mass
- 128.12011513
Names & identifiers
- Preferred name
- Allyl pentyl ether
- IUPAC
- 1-prop-2-enoxypentane
- English name
- ALLYL PENTYL ETHER
- Molecular formula
- C8H16O
- Molecular weight
- 128.21
Names & synonyms
Allyl pentyl ether23186-70-1Allylpentyl etherEther, allyl pentyl1-prop-2-enoxypentanePentane, 1-(2-propenyloxy)-Pentane, 1-(2-propen-1-yloxy)-Pentyl allyl ether1-(PROP-2-EN-1-YLOXY)PENTANESCHEMBL890683-(Pentyloxy)-1-propene #SCHEMBL170322
Show more names
1-(2-Propenyloxy)pentane
SCHEMBL459575SCHEMBL924284SCHEMBL925980SCHEMBL4849184SCHEMBL7520263DTXSID30177759QHOPNDWHOHMZPV-UHFFFAOYSA-N1-[(Prop-2-en-1-yl)oxy]pentane
Database identifiers
- CAS
23186-70-1- PubChem CID
- 141011
- DTXSID
DTXSID30177759- Nikkaji
- J108.753C
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 59.6
Physicochemical properties
- InChI
- InChI=1S/C8H16O/c1-3-5-6-8-9-7-4-2/h4H,2-3,5-8H2,1H3
- InChIKey
- QHOPNDWHOHMZPV-UHFFFAOYSA-N
- SMILES
- C(OCC=C)CCCC
Chemistry & industry
Suppliers3 total
JINING XINHE CHEMICAL CO., LTD+8615318402391 · [email protected]
常州英飒医药科技有限公司15151934985 · [email protected]
济宁心和化工有限公司152-64160071 15318402391 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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