(Z)-cyclopentylidene(ethoxy)methanolate

C8H12O2-2 — CID 134887346

IUPAC(Z)-cyclopentylidene(ethoxy)methanolate
SMILESCCO/C([O-])=C1/C[CH-]CC1
InChIInChI=1S/C8H13O2/c1-2-10-8(9)7-5-3-4-6-7/h3,9H,2,4-6H2,1H3/q-1/p-1/b8-7-
InChIKeyVJGMXRYXXGTDEV-FPLPWBNLSA-M
MW140.18 g/mol
LogP0.98
Rot. Bonds2

About (Z)-cyclopentylidene(ethoxy)methanolate

(Z)-cyclopentylidene(ethoxy)methanolate (PubChem CID 134887346) has the molecular formula C8H12O2-2 and a molecular weight of 140.18 g/mol. Its IUPAC name is (Z)-cyclopentylidene(ethoxy)methanolate.

Molecular Properties

Compound Name(Z)-cyclopentylidene(ethoxy)methanolate
PubChem CID134887346
Molecular FormulaC8H12O2-2
Molecular Weight140.18 g/mol
Exact Mass140.08
IUPAC Name(Z)-cyclopentylidene(ethoxy)methanolate
SMILESCCO/C([O-])=C1/C[CH-]CC1
InChIInChI=1S/C8H13O2/c1-2-10-8(9)7-5-3-4-6-7/h3,9H,2,4-6H2,1H3/q-1/p-1/b8-7-
InChIKeyVJGMXRYXXGTDEV-FPLPWBNLSA-M
XLogP0.98
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.18
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-cyclopentylidene(ethoxy)methanolate?
The IUPAC name of (Z)-cyclopentylidene(ethoxy)methanolate (CID 134887346) is (Z)-cyclopentylidene(ethoxy)methanolate.
What is the SMILES notation for (Z)-cyclopentylidene(ethoxy)methanolate?
The canonical SMILES for (Z)-cyclopentylidene(ethoxy)methanolate is CCO/C([O-])=C1/C[CH-]CC1.
What is the InChIKey of (Z)-cyclopentylidene(ethoxy)methanolate?
The InChIKey is VJGMXRYXXGTDEV-FPLPWBNLSA-M. The full InChI is InChI=1S/C8H13O2/c1-2-10-8(9)7-5-3-4-6-7/h3,9H,2,4-6H2,1H3/q-1/p-1/b8-7-.
What are the key properties of (Z)-cyclopentylidene(ethoxy)methanolate?
(Z)-cyclopentylidene(ethoxy)methanolate has a molecular weight of 140.18 g/mol, XLogP of 0.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-cyclopentylidene(ethoxy)methanolate is sourced from PubChem (CID 134887346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).