1,1-dibromo-3-propyl-1,3-disiletane

C5H12Br2Si2 — CID 172702517

IUPAC1,1-dibromo-3-propyl-1,3-disiletane
SMILESCCC[SiH]1C[Si](Br)(Br)C1
InChIInChI=1S/C5H12Br2Si2/c1-2-3-8-4-9(6,7)5-8/h8H,2-5H2,1H3
InChIKeyDDOQRDZOVUWMFV-UHFFFAOYSA-N
MW288.13 g/mol
LogP2.95
Rot. Bonds2

About 1,1-dibromo-3-propyl-1,3-disiletane

1,1-dibromo-3-propyl-1,3-disiletane (PubChem CID 172702517) has the molecular formula C5H12Br2Si2 and a molecular weight of 288.13 g/mol. Its IUPAC name is 1,1-dibromo-3-propyl-1,3-disiletane.

Molecular Properties

Compound Name1,1-dibromo-3-propyl-1,3-disiletane
PubChem CID172702517
Molecular FormulaC5H12Br2Si2
Molecular Weight288.13 g/mol
Exact Mass285.88
IUPAC Name1,1-dibromo-3-propyl-1,3-disiletane
SMILESCCC[SiH]1C[Si](Br)(Br)C1
InChIInChI=1S/C5H12Br2Si2/c1-2-3-8-4-9(6,7)5-8/h8H,2-5H2,1H3
InChIKeyDDOQRDZOVUWMFV-UHFFFAOYSA-N
XLogP2.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.13
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-1,3-dipropyl-1,3-disilinane
CID 172685707
1,3-dibromo-1,3-dipropyl-1,3-disiletane
CID 163405857
1-bromopropane;hydrobromide
CID 141072215
4-(4-propoxycyclohexyl)-1-propylsilinane
CID 18394471
butane;germane;dihydrobromide
CID 173448977
alumane;butane;dihydrobromide
CID 173417266
ethanol;gold;hydrobromide
CID 175287500
butane;cyclobutane
CID 162002820
4-(bromomethyl)-1-heptylsilinane
CID 54143052
(2S)-2-bromopentan-1-ol
CID 101373163
tetrapropylazanium;bromide;hydrobromide
CID 87689277
1-bromo-1-dodecylsilinane
CID 174630456

Frequently Asked Questions

What is the IUPAC name of 1,1-dibromo-3-propyl-1,3-disiletane?
The IUPAC name of 1,1-dibromo-3-propyl-1,3-disiletane (CID 172702517) is 1,1-dibromo-3-propyl-1,3-disiletane.
What is the SMILES notation for 1,1-dibromo-3-propyl-1,3-disiletane?
The canonical SMILES for 1,1-dibromo-3-propyl-1,3-disiletane is CCC[SiH]1C[Si](Br)(Br)C1.
What is the InChIKey of 1,1-dibromo-3-propyl-1,3-disiletane?
The InChIKey is DDOQRDZOVUWMFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12Br2Si2/c1-2-3-8-4-9(6,7)5-8/h8H,2-5H2,1H3.
What are the key properties of 1,1-dibromo-3-propyl-1,3-disiletane?
1,1-dibromo-3-propyl-1,3-disiletane has a molecular weight of 288.13 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dibromo-3-propyl-1,3-disiletane is sourced from PubChem (CID 172702517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).