CID 87905685

C14H19GeO — CID 87905685

IUPAC—
SMILESCC(O[Ge])=C(C)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C14H19GeO/c1-10(11(2)16-15)12-6-8-13(9-7-12)14(3,4)5/h6-9H,1-5H3
InChIKeyXDYSSVKOYCNHKX-UHFFFAOYSA-N
MW275.92 g/mol
LogP3.84
Rot. Bonds2

About CID 87905685

CID 87905685 (PubChem CID 87905685) has the molecular formula C14H19GeO and a molecular weight of 275.92 g/mol.

Molecular Properties

Compound NameCID 87905685
PubChem CID87905685
Molecular FormulaC14H19GeO
Molecular Weight275.92 g/mol
Exact Mass277.06
IUPAC Name—
SMILESCC(O[Ge])=C(C)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C14H19GeO/c1-10(11(2)16-15)12-6-8-13(9-7-12)14(3,4)5/h6-9H,1-5H3
InChIKeyXDYSSVKOYCNHKX-UHFFFAOYSA-N
XLogP3.84
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.92
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze CID 87905685 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-tert-butylphenyl)-2-methylbut-2-en-1-ol
CID 57275528
(Z)-1,2-bis(4-tert-butylphenyl)ethene-1,2-dithiolate
CID 102081798
1-(4-bromo-3-methylbut-2-en-2-yl)-4-tert-butylbenzene
CID 57144020
4-tert-butylbenzoic acid;copper
CID 67780260
2-(4-tert-butylphenyl)-3-methylbut-2-en-1-ol
CID 178015326
N-(4-tert-butylphenyl)-4-[(E)-3-[4-(N-(4-tert-butylphenyl)anilino)phenyl]but-2-en-2-yl]-N-phenylaniline
CID 157179618
1-tert-butyl-4-[3-(4-tert-butylphenyl)buta-1,3-dien-2-yl]benzene
CID 102332015
4-tert-butylphenol;cobalt
CID 174380967
1-tert-butyl-4-(1-diazoethyl)benzene
CID 102470296
1-(4-tert-butylphenyl)ethanimine
CID 20718021
(4-tert-butylbenzoyl)-methanidylazanium
CID 58832491
1-tert-butyl-4-[(E)-1-chloroprop-1-en-2-yl]benzene
CID 147586552

Frequently Asked Questions

What is the IUPAC name of CID 87905685?
The IUPAC name of CID 87905685 (CID 87905685) is not available.
What is the SMILES notation for CID 87905685?
The canonical SMILES for CID 87905685 is CC(O[Ge])=C(C)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of CID 87905685?
The InChIKey is XDYSSVKOYCNHKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19GeO/c1-10(11(2)16-15)12-6-8-13(9-7-12)14(3,4)5/h6-9H,1-5H3.
What are the key properties of CID 87905685?
CID 87905685 has a molecular weight of 275.92 g/mol, XLogP of 3.84, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87905685 is sourced from PubChem (CID 87905685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).