bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane

C15H33BrOSiZn — CID 56957600

IUPACbromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane
SMILES[CH2-]CC[C@H](C)CO[Si](C(C)C)(C(C)C)C(C)C.[Zn+]Br
InChIInChI=1S/C15H33OSi.BrH.Zn/c1-9-10-15(8)11-16-17(12(2)3,13(4)5)14(6)7;;/h12-15H,1,9-11H2,2-8H3;1H;/q-1;;+2/p-1/t15-;;/m0../s1
InChIKeyJAJZAVABNADQGS-CKUXDGONSA-M
MW402.81 g/mol
LogP6.27
Rot. Bonds8

About bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane

bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane (PubChem CID 56957600) has the molecular formula C15H33BrOSiZn and a molecular weight of 402.81 g/mol. Its IUPAC name is bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane.

Molecular Properties

Compound Namebromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane
PubChem CID56957600
Molecular FormulaC15H33BrOSiZn
Molecular Weight402.81 g/mol
Exact Mass400.08
IUPAC Namebromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane
SMILES[CH2-]CC[C@H](C)CO[Si](C(C)C)(C(C)C)C(C)C.[Zn+]Br
InChIInChI=1S/C15H33OSi.BrH.Zn/c1-9-10-15(8)11-16-17(12(2)3,13(4)5)14(6)7;;/h12-15H,1,9-11H2,2-8H3;1H;/q-1;;+2/p-1/t15-;;/m0../s1
InChIKeyJAJZAVABNADQGS-CKUXDGONSA-M
XLogP6.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.81
LogP ≤ 56.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(2S)-3-methoxy-2-methylpropoxy]-tri(propan-2-yl)silane
CID 57434729
(3R,7S)-7-methyl-8-tri(propan-2-yl)silyloxyoct-1-en-3-ol
CID 11738553
(2R)-2-[tri(propan-2-yl)silyloxymethyl]pentanal
CID 101236071
6-bromohexoxy-tri(propan-2-yl)silane
CID 89400609
1-tri(propan-2-yl)silyloxybut-3-yn-2-ol
CID 102024354
(E,4R)-4-methyl-5-tri(propan-2-yl)silyloxypent-2-en-3-ol
CID 11376118
[(Z,2S)-4-iodo-2-methylpent-3-enoxy]-tri(propan-2-yl)silane
CID 11176499
2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one
CID 71345142
6-chlorohexoxy-tri(propan-2-yl)silane
CID 89400729
5-[tert-butyl(dimethyl)silyl]oxy-4-methylpentan-1-ol
CID 14758907
carbanide;3,5,7-trimethylundecane;yttrium
CID 58340673
trimethyl(22-methyltetracosoxy)silane
CID 91745133

Frequently Asked Questions

What is the IUPAC name of bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane?
The IUPAC name of bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane (CID 56957600) is bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane.
What is the SMILES notation for bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane?
The canonical SMILES for bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane is [CH2-]CC[C@H](C)CO[Si](C(C)C)(C(C)C)C(C)C.[Zn+]Br.
What is the InChIKey of bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane?
The InChIKey is JAJZAVABNADQGS-CKUXDGONSA-M. The full InChI is InChI=1S/C15H33OSi.BrH.Zn/c1-9-10-15(8)11-16-17(12(2)3,13(4)5)14(6)7;;/h12-15H,1,9-11H2,2-8H3;1H;/q-1;;+2/p-1/t15-;;/m0../s1.
What are the key properties of bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane?
bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane has a molecular weight of 402.81 g/mol, XLogP of 6.27, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bromozinc(1+);[(2S)-2-methylpentoxy]-tri(propan-2-yl)silane is sourced from PubChem (CID 56957600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).