CID 16696901

C24H39GeP3 — CID 16696901

IUPAC—
SMILESCC(C)(C)PP(PC(C)(C)C)C(C)(C)C.c1ccc([Ge]c2ccccc2)cc1
InChIInChI=1S/C12H10Ge.C12H29P3/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-10(2,3)13-15(12(7,8)9)14-11(4,5)6/h1-10H;13-14H,1-9H3
InChIKeyZFFJZISQPBPYFC-UHFFFAOYSA-N
MW493.11 g/mol
LogP7.39
Rot. Bonds4

About CID 16696901

CID 16696901 (PubChem CID 16696901) has the molecular formula C24H39GeP3 and a molecular weight of 493.11 g/mol.

Molecular Properties

Compound NameCID 16696901
PubChem CID16696901
Molecular FormulaC24H39GeP3
Molecular Weight493.11 g/mol
Exact Mass494.15
IUPAC Name—
SMILESCC(C)(C)PP(PC(C)(C)C)C(C)(C)C.c1ccc([Ge]c2ccccc2)cc1
InChIInChI=1S/C12H10Ge.C12H29P3/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-10(2,3)13-15(12(7,8)9)14-11(4,5)6/h1-10H;13-14H,1-9H3
InChIKeyZFFJZISQPBPYFC-UHFFFAOYSA-N
XLogP7.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500493.11
LogP ≤ 57.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

CID 16696947
CID 16696947
tetraphenylboranuide;tritert-butylphosphane
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1,1-diphenylethanamine
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2,2-dimethylpropane;triphenylphosphane
CID 143924519
2-phenylpropan-2-ylbenzene
CID 13065
CID 171375456
CID 171375456
benzene;hexakis(2,2-dimethylpropane);ethane;naphthalene
CID 159135234
benzene;tetrakis(2,2-dimethylpropane);ethane;naphthalene
CID 163997399
benzyl(tert-butyl)phosphane;hydrochloride
CID 174737637
ditert-butyl(phenyl)phosphane;dichloropalladium
CID 87286096
dimethyl(2-phenylpropan-2-yl)borane
CID 154556081
phenoxybenzene;propane-2,2-diol
CID 174556232

Frequently Asked Questions

What is the IUPAC name of CID 16696901?
The IUPAC name of CID 16696901 (CID 16696901) is not available.
What is the SMILES notation for CID 16696901?
The canonical SMILES for CID 16696901 is CC(C)(C)PP(PC(C)(C)C)C(C)(C)C.c1ccc([Ge]c2ccccc2)cc1.
What is the InChIKey of CID 16696901?
The InChIKey is ZFFJZISQPBPYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Ge.C12H29P3/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-10(2,3)13-15(12(7,8)9)14-11(4,5)6/h1-10H;13-14H,1-9H3.
What are the key properties of CID 16696901?
CID 16696901 has a molecular weight of 493.11 g/mol, XLogP of 7.39, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 16696901 is sourced from PubChem (CID 16696901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).