(Z)-1-methoxybut-1-ene

C5H10O — CID 5366227

IUPAC(Z)-1-methoxybut-1-ene
SMILESCC/C=C\OC
InChIInChI=1S/C5H10O/c1-3-4-5-6-2/h4-5H,3H2,1-2H3/b5-4-
InChIKeyKMQWOHBEYVPGQJ-PLNGDYQASA-N
MW86.13 g/mol
LogP1.56
Rot. Bonds2

About (Z)-1-methoxybut-1-ene

(Z)-1-methoxybut-1-ene (PubChem CID 5366227) has the molecular formula C5H10O and a molecular weight of 86.13 g/mol. Its IUPAC name is (Z)-1-methoxybut-1-ene.

Molecular Properties

Compound Name(Z)-1-methoxybut-1-ene
PubChem CID5366227
Molecular FormulaC5H10O
Molecular Weight86.13 g/mol
Exact Mass86.07
IUPAC Name(Z)-1-methoxybut-1-ene
SMILESCC/C=C\OC
InChIInChI=1S/C5H10O/c1-3-4-5-6-2/h4-5H,3H2,1-2H3/b5-4-
InChIKeyKMQWOHBEYVPGQJ-PLNGDYQASA-N
XLogP1.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.13
LogP ≤ 51.56
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-methoxydodeca-1,3,5,7,9-pentaene
CID 71335564
1,8-dimethoxyocta-1,3,5,7-tetraene
CID 163444931
CID 169085448
CID 169085448
1-(2-methoxyethoxy)but-1-ene
CID 54192618
(E)-1-methoxyhept-1-ene
CID 11126280
(E)-1-methoxytridec-1-ene
CID 87204968
(E)-1-methoxyoct-1-ene
CID 10964624
(Z)-1-methoxydec-1-ene
CID 10888349
(E)-1-ethenoxybut-1-ene
CID 173170076
(Z)-1-[(2-methylpropan-2-yl)oxy]but-1-ene
CID 102396972
1,4-bis[(E)-but-1-enoxy]butane
CID 22051874
(E)-1-[(Z)-but-1-enoxy]pent-1-ene
CID 173340391

Frequently Asked Questions

What is the IUPAC name of (Z)-1-methoxybut-1-ene?
The IUPAC name of (Z)-1-methoxybut-1-ene (CID 5366227) is (Z)-1-methoxybut-1-ene.
What is the SMILES notation for (Z)-1-methoxybut-1-ene?
The canonical SMILES for (Z)-1-methoxybut-1-ene is CC/C=C\OC.
What is the InChIKey of (Z)-1-methoxybut-1-ene?
The InChIKey is KMQWOHBEYVPGQJ-PLNGDYQASA-N. The full InChI is InChI=1S/C5H10O/c1-3-4-5-6-2/h4-5H,3H2,1-2H3/b5-4-.
What are the key properties of (Z)-1-methoxybut-1-ene?
(Z)-1-methoxybut-1-ene has a molecular weight of 86.13 g/mol, XLogP of 1.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-methoxybut-1-ene is sourced from PubChem (CID 5366227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).