N-Triisopropylsilylpyrrole

HCID 145136CAS 87630-35-1
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)[Si](C(C)C)(C(C)C)n1cccc1
InChIKey
FBQURXLBJJNDBX-UHFFFAOYSA-N
Molecular formula
C13H25NSi
Average molar mass
223.43 g/mol
Monoisotopic mass
223.17562633

Names & identifiers

Preferred name
N-Triisopropylsilylpyrrole
IUPAC
tri(propan-2-yl)-pyrrol-1-ylsilane
English name
1-(TRIISOPROPYLSILYL)PYRROLE
Molecular formula
C13H25NSi
Molecular weight
223.43

Names & synonyms

87630-35-1N-TriisopropylsilylpyrroleDTXSID50236539RefChem:831199DTXCID301590301-(Triisopropylsilyl)pyrrole1-(Triisopropylsilyl)-1H-pyrrole1-[tris(propan-2-yl)silyl]-1H-pyrroletri(propan-2-yl)-pyrrol-1-ylsilaneMFCD00054932C13H25NSi1H-Pyrrole, 1-[tris(1-methylethyl)silyl]-
Show more names
1-[Tris(1-Methylethyl)silyl]-1H-pyrroleDK940DKSI181N-TRIISOPROPYLSILYL PYRROLE1-(Triisopropylsilyl)pyrrole 95%Tri-iso-propyl(pyrrol-1-yl)silane
1-triisopropylsilylpyrroleTIPS-pyrroleN-(Triisopropylsilyl)pyrroleSCHEMBL295451-triisopropylsilanyl-1H-pyrrole1-(TRIISOPROPYLSILYL)PYRROLE?s18025CS-10737

Database identifiers

CAS
87630-35-1
PubChem CID
145136
DTXSID
DTXSID50236539
EC Number
677-822-7
Nikkaji
J308.003J

Properties

Computed structural properties

Topological polar surface area
4.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
4
Heavy atoms
15

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical shift

Physicochemical properties

Boiling point
78 °C0.4 · 78 °C0.4 mm Hg(lit.)
Density
0.904 g/mL · 0.904 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.492(lit.)
Flash point
224 °F · 224 °F
storage temp.
2 · Inert atmosphere,2-8°C
form
clear liquid

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302+H332 (86.7%): Harmful if swallowed or if inhaled [Warning Acute toxicity, oral; acute toxicity, inhalation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P304+P340, P305+P351+P338, P317, P330, P337+P317, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (97.8%)

Safety data

wgk
3
hs_code
2933998090
risk_code
20-22-36
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn

Chemistry & industry

Applications · 2 items

Uses1-(Triisopropylsilyl)pyrrole may be employed as reagent in perfluoroalkylation and Vilsmeier formylation reactions. It may be used in the preparation of:ethyl 2-(2,4-dinitrophenylhydrazono]-3-[ 1-(triisopropylsily1)-pyrrol-2-yflpropanoateheterocyclic base, 3-nitropyrrole3-nitropyrrole, required for the synthesis of 1 -(2′-deoxy-β-D-ribofuranosyl)-3-nitropyrrole

General Description1-(Triisopropylsilyl)pyrrole (TISP), a heterocyclic building block, is a pyrrole derivative. TISP has been reported to generate pyrrolic cation radicals during cyclovoltammetric studies, via electroreduction. It participates in various electrophilic substitution reactions specifically at β-position, via reaction with various electrophilic reagents (Br+, I+,NO2+,etc).

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

Related reactions

43 records
New reaction record

Linked notes

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