dibenzyl-butyl-chlorostannane

C18H23ClSn — CID 14517512

IUPACdibenzyl-butyl-chlorostannane
SMILESCCCC[Sn](Cl)(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/2C7H7.C4H9.ClH.Sn/c2*1-7-5-3-2-4-6-7;1-3-4-2;;/h2*2-6H,1H2;1,3-4H2,2H3;1H;/q;;;;+1/p-1
InChIKeyHUDSQGYIUMUKFD-UHFFFAOYSA-M
MW393.55 g/mol
LogP5.53
Rot. Bonds7

About dibenzyl-butyl-chlorostannane

dibenzyl-butyl-chlorostannane (PubChem CID 14517512) has the molecular formula C18H23ClSn and a molecular weight of 393.55 g/mol. Its IUPAC name is dibenzyl-butyl-chlorostannane.

Molecular Properties

Compound Namedibenzyl-butyl-chlorostannane
PubChem CID14517512
Molecular FormulaC18H23ClSn
Molecular Weight393.55 g/mol
Exact Mass394.05
IUPAC Namedibenzyl-butyl-chlorostannane
SMILESCCCC[Sn](Cl)(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/2C7H7.C4H9.ClH.Sn/c2*1-7-5-3-2-4-6-7;1-3-4-2;;/h2*2-6H,1H2;1,3-4H2,2H3;1H;/q;;;;+1/p-1
InChIKeyHUDSQGYIUMUKFD-UHFFFAOYSA-M
XLogP5.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.55
LogP ≤ 55.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

tributyl-[(S)-deuterio(phenyl)methyl]stannane
CID 138962774
sulfane;bis(tributyl(phenyl)stannane)
CID 67835272
butyl-tris(phenylmethoxy)stannane
CID 16688200
hexakis(decane);ethylbenzene
CID 173398562
sodium;hydride;pentadecylbenzene
CID 173461904
pentanonacontylbenzene
CID 165359347
butylbenzene;propylbenzene
CID 142022125
octacosylbenzene
CID 14228596
pentadecane;pentadecylbenzene
CID 174970881
octylbenzene
CID 16607
octaoctacontylbenzene
CID 165359374
pentane;2-phenylacetonitrile
CID 175401788

Frequently Asked Questions

What is the IUPAC name of dibenzyl-butyl-chlorostannane?
The IUPAC name of dibenzyl-butyl-chlorostannane (CID 14517512) is dibenzyl-butyl-chlorostannane.
What is the SMILES notation for dibenzyl-butyl-chlorostannane?
The canonical SMILES for dibenzyl-butyl-chlorostannane is CCCC[Sn](Cl)(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of dibenzyl-butyl-chlorostannane?
The InChIKey is HUDSQGYIUMUKFD-UHFFFAOYSA-M. The full InChI is InChI=1S/2C7H7.C4H9.ClH.Sn/c2*1-7-5-3-2-4-6-7;1-3-4-2;;/h2*2-6H,1H2;1,3-4H2,2H3;1H;/q;;;;+1/p-1.
What are the key properties of dibenzyl-butyl-chlorostannane?
dibenzyl-butyl-chlorostannane has a molecular weight of 393.55 g/mol, XLogP of 5.53, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzyl-butyl-chlorostannane is sourced from PubChem (CID 14517512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).