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1H-Indole-3-acetic acid, 1-(trimethylsilyl)-, trimethylsilyl ester

HCID 530195
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Basic information

CAS
56114-66-0
Standard SMILES
C[Si](C)(C)OC(=O)Cc1cn([Si](C)(C)C)c2ccccc12
InChIKey
WKJCHYMUOINQGJ-UHFFFAOYSA-N
Molecular formula
C16H25NO2Si2
Average molar mass
319.54 g/mol
Monoisotopic mass
319.14238211

Names & identifiers

Preferred name
1H-Indole-3-acetic acid, 1-(trimethylsilyl)-, trimethylsilyl ester
IUPAC
trimethylsilyl 2-(1-trimethylsilylindol-3-yl)acetate
English name
1-Trimethylsilyl-1H-indole-3-acetic acid trimethylsilyl ester
Molecular formula
C16H25NO2Si2
Molecular weight
319.55

Names & synonyms

Indol-3-acetic acid, di-TMS1H-Indole-3-acetic acid, 1-(trimethylsilyl)-, trimethylsilyl ester56114-66-0Indole-3-acetic acid, 2TMSIndole-3-acetic acid, diTMSIndole-3-acetic acid, bis-TMSIndol-3-acetic acid, (2TMS)Trimethylsilyl [1-(trimethylsilyl)-1H-indol-3-yl]acetateWKJCHYMUOINQGJ-UHFFFAOYSA-NDTXSID1013470763-INDOLEACETIC ACID-DI-TMS3-Indoleacetic acid, 2TMS derivative
Show more names
1-Trimethylsilyl-1H-indole-3-acetic acid trimethylsilyl ester
Q63395607trimethylsilyl (1-trimethylsilyl-1h-indol-3-yl)acetateTrimethylsilyl [1-(trimethylsilyl)-1H-indol-3-yl]acetate #

Database identifiers

CAS
56114-66-0
PubChem CID
530195
DTXSID
DTXSID101347076
Nikkaji
J45.233E

Properties

Computed structural properties

Topological polar surface area
31.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
387

Physicochemical properties

Boiling point
321.3 · 321.3±34.0 °C(Predicted)
Density
0.99 · 0.99±0.1 g/cm3(Predicted)

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