tri(propan-2-yl)germyl 2-methylprop-2-enoate

C13H26GeO2 — CID 101025026

IUPACtri(propan-2-yl)germyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[Ge](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C13H26GeO2/c1-9(2)13(15)16-14(10(3)4,11(5)6)12(7)8/h10-12H,1H2,2-8H3
InChIKeyBKFXDMMYOBQBOL-UHFFFAOYSA-N
MW286.96 g/mol
LogP4.28
Rot. Bonds5

About tri(propan-2-yl)germyl 2-methylprop-2-enoate

tri(propan-2-yl)germyl 2-methylprop-2-enoate (PubChem CID 101025026) has the molecular formula C13H26GeO2 and a molecular weight of 286.96 g/mol. Its IUPAC name is tri(propan-2-yl)germyl 2-methylprop-2-enoate.

Molecular Properties

Compound Nametri(propan-2-yl)germyl 2-methylprop-2-enoate
PubChem CID101025026
Molecular FormulaC13H26GeO2
Molecular Weight286.96 g/mol
Exact Mass288.11
IUPAC Nametri(propan-2-yl)germyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[Ge](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C13H26GeO2/c1-9(2)13(15)16-14(10(3)4,11(5)6)12(7)8/h10-12H,1H2,2-8H3
InChIKeyBKFXDMMYOBQBOL-UHFFFAOYSA-N
XLogP4.28
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.96
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)germyl 2-methylprop-2-enoate?
The IUPAC name of tri(propan-2-yl)germyl 2-methylprop-2-enoate (CID 101025026) is tri(propan-2-yl)germyl 2-methylprop-2-enoate.
What is the SMILES notation for tri(propan-2-yl)germyl 2-methylprop-2-enoate?
The canonical SMILES for tri(propan-2-yl)germyl 2-methylprop-2-enoate is C=C(C)C(=O)O[Ge](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)germyl 2-methylprop-2-enoate?
The InChIKey is BKFXDMMYOBQBOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26GeO2/c1-9(2)13(15)16-14(10(3)4,11(5)6)12(7)8/h10-12H,1H2,2-8H3.
What are the key properties of tri(propan-2-yl)germyl 2-methylprop-2-enoate?
tri(propan-2-yl)germyl 2-methylprop-2-enoate has a molecular weight of 286.96 g/mol, XLogP of 4.28, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)germyl 2-methylprop-2-enoate is sourced from PubChem (CID 101025026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).