CID 136871061

C36H92Si10 — CID 136871061

IUPAC—
SMILESCC(C)[Si](C(C)C)([Si]([Si](C)(C)C)[Si](C)(C)C)[Si](C(C)C)(C(C)C)[Si](C(C)C)(C(C)C)[Si](C(C)C)(C(C)C)[Si]([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C36H92Si10/c1-29(2)43(30(3)4,37(39(17,18)19)40(20,21)22)45(33(9)10,34(11)12)46(35(13)14,36(15)16)44(31(5)6,32(7)8)38(41(23,24)25)42(26,27)28/h29-36H,1-28H3
InChIKeyGVIINOJYFKMJSP-UHFFFAOYSA-N
MW805.99 g/mol
LogP14.11
Rot. Bonds17

About CID 136871061

CID 136871061 (PubChem CID 136871061) has the molecular formula C36H92Si10 and a molecular weight of 805.99 g/mol.

Molecular Properties

Compound NameCID 136871061
PubChem CID136871061
Molecular FormulaC36H92Si10
Molecular Weight805.99 g/mol
Exact Mass804.49
IUPAC Name—
SMILESCC(C)[Si](C(C)C)([Si]([Si](C)(C)C)[Si](C)(C)C)[Si](C(C)C)(C(C)C)[Si](C(C)C)(C(C)C)[Si](C(C)C)(C(C)C)[Si]([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C36H92Si10/c1-29(2)43(30(3)4,37(39(17,18)19)40(20,21)22)45(33(9)10,34(11)12)46(35(13)14,36(15)16)44(31(5)6,32(7)8)38(41(23,24)25)42(26,27)28/h29-36H,1-28H3
InChIKeyGVIINOJYFKMJSP-UHFFFAOYSA-N
XLogP14.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds17
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500805.99
LogP ≤ 514.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 136871061?
The IUPAC name of CID 136871061 (CID 136871061) is not available.
What is the SMILES notation for CID 136871061?
The canonical SMILES for CID 136871061 is CC(C)[Si](C(C)C)([Si]([Si](C)(C)C)[Si](C)(C)C)[Si](C(C)C)(C(C)C)[Si](C(C)C)(C(C)C)[Si](C(C)C)(C(C)C)[Si]([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of CID 136871061?
The InChIKey is GVIINOJYFKMJSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H92Si10/c1-29(2)43(30(3)4,37(39(17,18)19)40(20,21)22)45(33(9)10,34(11)12)46(35(13)14,36(15)16)44(31(5)6,32(7)8)38(41(23,24)25)42(26,27)28/h29-36H,1-28H3.
What are the key properties of CID 136871061?
CID 136871061 has a molecular weight of 805.99 g/mol, XLogP of 14.11, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136871061 is sourced from PubChem (CID 136871061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).