2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene

C10H16O3 — CID 87378028

IUPAC2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene
SMILESC=C(C)C(=O)O.C=C(C)OC(=C)C
InChIInChI=1S/C6H10O.C4H6O2/c1-5(2)7-6(3)4;1-3(2)4(5)6/h1,3H2,2,4H3;1H2,2H3,(H,5,6)
InChIKeyQMAZRVRGIHRPGT-UHFFFAOYSA-N
MW184.23 g/mol
LogP2.72
Rot. Bonds3

About 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene

2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene (PubChem CID 87378028) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene.

Molecular Properties

Compound Name2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene
PubChem CID87378028
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene
SMILESC=C(C)C(=O)O.C=C(C)OC(=C)C
InChIInChI=1S/C6H10O.C4H6O2/c1-5(2)7-6(3)4;1-3(2)4(5)6/h1,3H2,2,4H3;1H2,2H3,(H,5,6)
InChIKeyQMAZRVRGIHRPGT-UHFFFAOYSA-N
XLogP2.72
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-Propenoic acid,2-methyl-, aluminum salt (3:1)
CID 87069865
CID 131883821
CID 131883821
tris(2-methylprop-2-enoic acid);yttrium
CID 121233543
ethane;bis(2-methylprop-2-enoic acid)
CID 87619293
acetic acid;2-methylprop-2-enoic acid
CID 21426946
ethene;bis(2-methylprop-2-enoic acid)
CID 158500428
tris(2-methylprop-2-enoic acid);zirconium
CID 175448767
λ2-plumbane;2-methylprop-2-enoic acid
CID 173012443
strontium;hydride;2-methylprop-2-enoic acid
CID 173027566
dilithium;hydride;2-methylprop-2-enoic acid
CID 174560536
acetic acid;cadmium;2-methylprop-2-enoic acid
CID 88716408
chromium;bis(2-methylprop-2-enoic acid);hydrate
CID 165107719

Frequently Asked Questions

What is the IUPAC name of 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene?
The IUPAC name of 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene (CID 87378028) is 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene.
What is the SMILES notation for 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene?
The canonical SMILES for 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene is C=C(C)C(=O)O.C=C(C)OC(=C)C.
What is the InChIKey of 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene?
The InChIKey is QMAZRVRGIHRPGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O.C4H6O2/c1-5(2)7-6(3)4;1-3(2)4(5)6/h1,3H2,2,4H3;1H2,2H3,(H,5,6).
What are the key properties of 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene?
2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene has a molecular weight of 184.23 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylprop-2-enoic acid;2-prop-1-en-2-yloxyprop-1-ene is sourced from PubChem (CID 87378028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).