ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene

C10H20O2 — CID 174797706

IUPACethoxyethane;2-prop-1-en-2-yloxyprop-1-ene
SMILESC=C(C)OC(=C)C.CCOCC
InChIInChI=1S/C6H10O.C4H10O/c1-5(2)7-6(3)4;1-3-5-4-2/h1,3H2,2,4H3;3-4H2,1-2H3
InChIKeyVKRJLWVQGAFMHU-UHFFFAOYSA-N
MW172.27 g/mol
LogP3.11
Rot. Bonds4

About ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene

ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene (PubChem CID 174797706) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene.

Molecular Properties

Compound Nameethoxyethane;2-prop-1-en-2-yloxyprop-1-ene
PubChem CID174797706
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Nameethoxyethane;2-prop-1-en-2-yloxyprop-1-ene
SMILESC=C(C)OC(=C)C.CCOCC
InChIInChI=1S/C6H10O.C4H10O/c1-5(2)7-6(3)4;1-3-5-4-2/h1,3H2,2,4H3;3-4H2,1-2H3
InChIKeyVKRJLWVQGAFMHU-UHFFFAOYSA-N
XLogP3.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

ethoxyethane;2-methylprop-1-ene
CID 19913928
ethoxyethane
CID 18694919
ethoxyethane
CID 19002445
ethanol;ethene;ethoxyethane
CID 139434375
ethoxyethane;hydroxylamine
CID 135816400
ethoxyethane;formaldehyde
CID 174286087
2-[2-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene
CID 175050176
ethane-1,2-diol;ethene;ethoxyethane
CID 173171004
ethane-1,2-diol;ethene;ethoxyethane
CID 173009607
ethoxyethane;sulfane
CID 90240371
ethoxyethane;hydrate
CID 22594236
disodium;ethoxyethane
CID 23107014

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene?
The IUPAC name of ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene (CID 174797706) is ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene.
What is the SMILES notation for ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene?
The canonical SMILES for ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene is C=C(C)OC(=C)C.CCOCC.
What is the InChIKey of ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene?
The InChIKey is VKRJLWVQGAFMHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O.C4H10O/c1-5(2)7-6(3)4;1-3-5-4-2/h1,3H2,2,4H3;3-4H2,1-2H3.
What are the key properties of ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene?
ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene has a molecular weight of 172.27 g/mol, XLogP of 3.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;2-prop-1-en-2-yloxyprop-1-ene is sourced from PubChem (CID 174797706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).