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1-(2-Propenyloxy)heptane

HCID 27904
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Basic information

CAS
16519-24-7
Standard SMILES
C=CCOCCCCCCC
InChIKey
BWRRFWFYPAZQMD-UHFFFAOYSA-N
Molecular formula
C10H20O
Average molar mass
156.26 g/mol
Monoisotopic mass
156.15141526

Names & identifiers

Preferred name
1-(2-Propenyloxy)heptane
IUPAC
1-prop-2-enoxyheptane
English name
1-(2-Propenyloxy)heptane
Molecular formula
C10H20O
Molecular weight
156.27

Names & synonyms

1-(2-PROPENYLOXY)HEPTANE16519-24-71-prop-2-enoxyheptaneEther, allyl heptylHeptane, 1-(2-propenyloxy)-Allyl heptyl ether3-(Heptyloxy)-1-propeneSCHEMBL924287SCHEMBL8482912DTXSID30167857BWRRFWFYPAZQMD-UHFFFAOYSA-N1-[(Prop-2-en-1-yl)oxy]heptane
Show more names
Heptane, 1-(2-propen-1-yloxy)-

Database identifiers

CAS
16519-24-7
PubChem CID
27904
DTXSID
DTXSID30167857
Nikkaji
J129.252H

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
8
Heavy atoms
11
Formal charge
0
Complexity
78.9

Physicochemical properties

Boiling point
190.2 · 190.2±9.0 °C(Predicted)
Density
0.801 · 0.801±0.06 g/cm3(Predicted)

Related reactions

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