tribromo(3-phenylmethoxypropyl)silane

C10H13Br3OSi — CID 66954985

IUPACtribromo(3-phenylmethoxypropyl)silane
SMILESBr[Si](Br)(Br)CCCOCc1ccccc1
InChIInChI=1S/C10H13Br3OSi/c11-15(12,13)8-4-7-14-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2
InChIKeyGNFASNGPRPMXAG-UHFFFAOYSA-N
MW417.01 g/mol
LogP4.72
Rot. Bonds6

About tribromo(3-phenylmethoxypropyl)silane

tribromo(3-phenylmethoxypropyl)silane (PubChem CID 66954985) has the molecular formula C10H13Br3OSi and a molecular weight of 417.01 g/mol. Its IUPAC name is tribromo(3-phenylmethoxypropyl)silane.

Molecular Properties

Compound Nametribromo(3-phenylmethoxypropyl)silane
PubChem CID66954985
Molecular FormulaC10H13Br3OSi
Molecular Weight417.01 g/mol
Exact Mass413.83
IUPAC Nametribromo(3-phenylmethoxypropyl)silane
SMILESBr[Si](Br)(Br)CCCOCc1ccccc1
InChIInChI=1S/C10H13Br3OSi/c11-15(12,13)8-4-7-14-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2
InChIKeyGNFASNGPRPMXAG-UHFFFAOYSA-N
XLogP4.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.01
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-[2-(5-phenylmethoxypentoxy)ethoxy]pentoxymethylbenzene
CID 135358353
5-bromopentoxymethylbenzene;1,5-dibromopentane
CID 161240377
15-bromopentadecoxymethylbenzene
CID 11338468
trimethyl(11-phenylmethoxyundecyl)silane
CID 20775242
2,4,6-tris(4-phenylmethoxybutoxy)-1,3,5-triazine
CID 139880669
butoxymethylbenzene;ethane
CID 145341806
(9-bromo-9,9-dideuteriononoxy)methylbenzene
CID 162744112
lithium;butoxymethylbenzene;hydride
CID 175482454
2-[2-[2-(3-phenylmethoxypropoxy)ethoxy]ethoxy]ethanamine
CID 139363224
1,3,5-tris[5-[3,5-bis[5-[3,5-bis(5-phenylmethoxypentoxy)phenoxy]pentoxy]phenoxy]pentoxy]benzene
CID 134929469
5-(5-phenylmethoxypentoxy)pentan-1-ol
CID 155584786
20-phenylmethoxyicos-10-enoxymethylbenzene
CID 54404919

Frequently Asked Questions

What is the IUPAC name of tribromo(3-phenylmethoxypropyl)silane?
The IUPAC name of tribromo(3-phenylmethoxypropyl)silane (CID 66954985) is tribromo(3-phenylmethoxypropyl)silane.
What is the SMILES notation for tribromo(3-phenylmethoxypropyl)silane?
The canonical SMILES for tribromo(3-phenylmethoxypropyl)silane is Br[Si](Br)(Br)CCCOCc1ccccc1.
What is the InChIKey of tribromo(3-phenylmethoxypropyl)silane?
The InChIKey is GNFASNGPRPMXAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Br3OSi/c11-15(12,13)8-4-7-14-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2.
What are the key properties of tribromo(3-phenylmethoxypropyl)silane?
tribromo(3-phenylmethoxypropyl)silane has a molecular weight of 417.01 g/mol, XLogP of 4.72, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tribromo(3-phenylmethoxypropyl)silane is sourced from PubChem (CID 66954985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).