(Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene

C9H18O — CID 102396973

IUPAC(Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene
SMILESCCC/C=C\OC(C)(C)C
InChIInChI=1S/C9H18O/c1-5-6-7-8-10-9(2,3)4/h7-8H,5-6H2,1-4H3/b8-7-
InChIKeyRPVJJLVSWBGPBA-FPLPWBNLSA-N
MW142.24 g/mol
LogP3.12
Rot. Bonds3

About (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene

(Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene (PubChem CID 102396973) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene.

Molecular Properties

Compound Name(Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene
PubChem CID102396973
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name(Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene
SMILESCCC/C=C\OC(C)(C)C
InChIInChI=1S/C9H18O/c1-5-6-7-8-10-9(2,3)4/h7-8H,5-6H2,1-4H3/b8-7-
InChIKeyRPVJJLVSWBGPBA-FPLPWBNLSA-N
XLogP3.12
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Ethoxy-1-hexene
CID 10877141
(e)-1-Butenyl 2-methylpropyl ether
CID 13782479
Furan, 2,3-dihydro-2,2-dimethyl-
CID 11094546
(z)-1-Ethoxy-1,5-hexadiene
CID 11126266
1-Hexene, 1-ethoxy-
CID 53422434
3Butyl butenyl ether
CID 53685065
Dihexenyl-ether
CID 54009821
Dipentenyloxyd
CID 54419578
(E)-2-methyl-1-[(2-methylpropan-2-yl)oxy]but-1-ene
CID 13138919
(3E)-3-(ethoxymethylidene)hex-1-ene
CID 13495212
(z)-1-Butenyl 2-methylpropyl ether
CID 13782480
(E)-1-[(2-methylpropan-2-yl)oxy]undec-1-ene
CID 15883246

Frequently Asked Questions

What is the IUPAC name of (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene?
The IUPAC name of (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene (CID 102396973) is (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene.
What is the SMILES notation for (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene?
The canonical SMILES for (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene is CCC/C=C\OC(C)(C)C.
What is the InChIKey of (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene?
The InChIKey is RPVJJLVSWBGPBA-FPLPWBNLSA-N. The full InChI is InChI=1S/C9H18O/c1-5-6-7-8-10-9(2,3)4/h7-8H,5-6H2,1-4H3/b8-7-.
What are the key properties of (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene?
(Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene has a molecular weight of 142.24 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[(2-methylpropan-2-yl)oxy]pent-1-ene is sourced from PubChem (CID 102396973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).