CAS 92511-12-1 tert-Butyl(4-iodobutoxy)dimethylsilane (HCID 4250746)

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Basic information

CAS: 92511-12-1
Standard SMILES: CC(C)(C)[Si](C)(C)OCCCCI
InChIKey: INGJYKISFRSCQV-UHFFFAOYSA-N
Molecular formula: C10H23IOSi
Average molar mass: 314.28 g/mol
Monoisotopic mass: 314.05628989

Names & identifiers

Preferred name: tert-Butyl(4-iodobutoxy)dimethylsilane
IUPAC: tert-butyl-(4-iodobutoxy)-dimethylsilane
English name: TERT-BUTYL(4-IODOBUTOXY)DIMETHYLSILANE
Molecular formula: C10H23IOSi
Molecular weight: 314.28

Names & synonyms

tert-Butyl(4-iodobutoxy)dimethylsilane92511-12-1DTXSID30401223RefChem:383868DTXCID20352078861-295-7tert-butyl-(4-iodobutoxy)-dimethylsilane(4-Iodobutoxy)-t-butyldimethylsilaneMFCD018636951-(tert-Butyldimethylsilyloxy)-4-iodobutaneC10H23IOSitert-Butyl (4-iodobutoxy)dimethylsilane

Show more names

DK952DK425DKSI055DKFELEX0255ert-butyl-(4-iodobutoxy)-dimethylsilane(4-iodobutoxy)(tert-butyl)dimethylsilane4-tert-Butyldimethylsilyloxy-1-iodobutanetert-Butyl(4-iodobutoxy)diMethylsilane 95%

(4-iodobutoxy)dimethyLSilane,(1,1-dimethylethyl)(4-iodobutoxy)dimethyl-TERT-BUTYL-(4-IODO-BUTOXY)-DIMETHYL-SILANESCHEMBL345800Silane, (1,1-dimethylethyl)(4-iodobutoxy)dimethyl-4-iodo-1-(1,1,2,2-tetramethyl-1-silapropoxy)butaneorb31768571-t-butyldimethylsilyloxy-4-iodobutane

Database identifiers

CAS: 92511-12-1
PubChem CID

Properties

Computed structural properties

Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 6
Heavy atoms: 13
Formal charge: 0
Complexity: 140

Physicochemical properties

Boiling point: 75 °C/0.5 · 75 °C/0.5 mmHg (lit.)
Density: 1.214 g/mL · 1.214 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.48(lit.)
Flash point: 230 °F · >230 °F
storage temp.: RT, protect from light
Specific Gravity: 1.214 · 1.214
Appearance: Yellow to orange Liquid
Hydrolytic Sensitivity: 7 · 7: reacts slowly with moisture/water
InChI: InChI=1S/C10H23IOSi/c1-10(2,3)13(4,5)12-9-7-6-8-11/h6-9H2,1-5H3
InChIKey: INGJYKISFRSCQV-UHFFFAOYSA-N
SMILES: [Si](C(C)(C)C)(OCCCCI)(C)C
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE: Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
wgk: 3
tsca: No
hs_code: 2931900090
Signal word: Warning
Symbol(GHS): GHS07
Storage Class: 10 - Combustible liquids
Hazard statements: H302
Precautionary statements: P280-P305+P351+P338

Chemistry & industry

Applications

Usestert-Butyl(4-iodobutoxy)dimethylsilane may be used as a reagent in the multi-step synthesis of spermine synthon and decanucleotide-spermine conjugates.

General Descriptiontert-Butyl(4-iodobutoxy)dimethylsilane is an iodoorganosilane that can be synthesized from tert-butyl(chloro)dimethylsilane.