(E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide

C5H10BrO2Zn- — CID 101021696

IUPAC(E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide
SMILESC/C=C/OCOC.[Br-].[Zn]
InChIInChI=1S/C5H10O2.BrH.Zn/c1-3-4-7-5-6-2;;/h3-4H,5H2,1-2H3;1H;/p-1/b4-3+;;
InChIKeyJMGWODHMWQTJIW-CZEFNJPISA-M
MW247.43 g/mol
LogP-1.86
Rot. Bonds3

About (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide

(E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide (PubChem CID 101021696) has the molecular formula C5H10BrO2Zn- and a molecular weight of 247.43 g/mol. Its IUPAC name is (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide.

Molecular Properties

Compound Name(E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide
PubChem CID101021696
Molecular FormulaC5H10BrO2Zn-
Molecular Weight247.43 g/mol
Exact Mass244.92
IUPAC Name(E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide
SMILESC/C=C/OCOC.[Br-].[Zn]
InChIInChI=1S/C5H10O2.BrH.Zn/c1-3-4-7-5-6-2;;/h3-4H,5H2,1-2H3;1H;/p-1/b4-3+;;
InChIKeyJMGWODHMWQTJIW-CZEFNJPISA-M
XLogP-1.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.43
LogP ≤ 5-1.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 134890511
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(1E,5E)-1-(methoxymethoxy)hepta-1,5-dien-4-ol
CID 134978986
1-[(Z)-prop-1-enoxy]-4-[(E)-prop-1-enoxy]butane
CID 131862355
acetic acid;1-(2-methoxyethoxy)prop-1-ene
CID 118619515
1-(methoxymethoxy)hexadec-1-ene
CID 175225374
17,17-dimethoxy-1-(methoxymethoxy)heptadec-1-ene
CID 163205994
1-prop-1-enoxybut-2-ene
CID 21944
1,10-bis(prop-1-enoxy)decane
CID 54271291
(E)-4-[(E)-prop-1-enoxy]-1-[(E)-4-[(E)-4-[(E)-prop-1-enoxy]but-1-enoxy]but-3-enoxy]but-1-ene
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4-prop-1-enoxybutan-2-one
CID 71435661
11,11-diethoxy-1-(methoxymethoxy)undec-1-ene
CID 162392533

Frequently Asked Questions

What is the IUPAC name of (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide?
The IUPAC name of (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide (CID 101021696) is (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide.
What is the SMILES notation for (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide?
The canonical SMILES for (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide is C/C=C/OCOC.[Br-].[Zn].
What is the InChIKey of (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide?
The InChIKey is JMGWODHMWQTJIW-CZEFNJPISA-M. The full InChI is InChI=1S/C5H10O2.BrH.Zn/c1-3-4-7-5-6-2;;/h3-4H,5H2,1-2H3;1H;/p-1/b4-3+;;.
What are the key properties of (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide?
(E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide has a molecular weight of 247.43 g/mol, XLogP of -1.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(methoxymethoxy)prop-1-ene;zinc;bromide is sourced from PubChem (CID 101021696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).