ethane;4-methoxy-2,4-dimethylpent-1-ene

C10H22O — CID 143762978

IUPACethane;4-methoxy-2,4-dimethylpent-1-ene
SMILESC=C(C)CC(C)(C)OC.CC
InChIInChI=1S/C8H16O.C2H6/c1-7(2)6-8(3,4)9-5;1-2/h1,6H2,2-5H3;1-2H3
InChIKeyRUEQJHISBASMPO-UHFFFAOYSA-N
MW158.28 g/mol
LogP3.40
Rot. Bonds3

About ethane;4-methoxy-2,4-dimethylpent-1-ene

ethane;4-methoxy-2,4-dimethylpent-1-ene (PubChem CID 143762978) has the molecular formula C10H22O and a molecular weight of 158.28 g/mol. Its IUPAC name is ethane;4-methoxy-2,4-dimethylpent-1-ene.

Molecular Properties

Compound Nameethane;4-methoxy-2,4-dimethylpent-1-ene
PubChem CID143762978
Molecular FormulaC10H22O
Molecular Weight158.28 g/mol
Exact Mass158.17
IUPAC Nameethane;4-methoxy-2,4-dimethylpent-1-ene
SMILESC=C(C)CC(C)(C)OC.CC
InChIInChI=1S/C8H16O.C2H6/c1-7(2)6-8(3,4)9-5;1-2/h1,6H2,2-5H3;1-2H3
InChIKeyRUEQJHISBASMPO-UHFFFAOYSA-N
XLogP3.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.28
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-Methoxy-2,4,5,5-tetramethylhex-1-ene
CID 134930792
2,6-Dimethyl-2-methoxyhept-5-ene
CID 14793993
2-Methoxy-2-methylhex-5-ene
CID 14793999
4-Methoxy-2,4-dimethylpent-1-ene
CID 20657319
(4S)-4-methoxy-4-methylocta-1,7-diene
CID 59910982
4,4-Dideuterio-5-methoxy-5-methylhex-1-ene
CID 89211905
4-Methoxy-4-methylhept-1-ene
CID 90780592
2,3,3-Trimethyl-4-(2-methylpentan-2-yloxy)but-1-ene
CID 123757864
2,4-Dimethyl-4-propoxypent-1-ene
CID 126633101
Ethane;4-ethoxy-2,4-dimethylpent-1-ene
CID 143164227
4-Ethoxy-2,4-dimethylpent-1-ene
CID 143164228
(4S)-4-methoxy-2,4-dimethylhex-1-ene
CID 143164233

Frequently Asked Questions

What is the IUPAC name of ethane;4-methoxy-2,4-dimethylpent-1-ene?
The IUPAC name of ethane;4-methoxy-2,4-dimethylpent-1-ene (CID 143762978) is ethane;4-methoxy-2,4-dimethylpent-1-ene.
What is the SMILES notation for ethane;4-methoxy-2,4-dimethylpent-1-ene?
The canonical SMILES for ethane;4-methoxy-2,4-dimethylpent-1-ene is C=C(C)CC(C)(C)OC.CC.
What is the InChIKey of ethane;4-methoxy-2,4-dimethylpent-1-ene?
The InChIKey is RUEQJHISBASMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O.C2H6/c1-7(2)6-8(3,4)9-5;1-2/h1,6H2,2-5H3;1-2H3.
What are the key properties of ethane;4-methoxy-2,4-dimethylpent-1-ene?
ethane;4-methoxy-2,4-dimethylpent-1-ene has a molecular weight of 158.28 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methoxy-2,4-dimethylpent-1-ene is sourced from PubChem (CID 143762978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).