4-[(Trimethylsilyl)ethynyl]benzonitrile - CAS 75867-40-2
Catalog: |
BB035423 |
Product Name: |
4-[(Trimethylsilyl)ethynyl]benzonitrile |
CAS: |
75867-40-2 |
Synonyms: |
4-(2-trimethylsilylethynyl)benzonitrile |
IUPAC Name: | 4-(2-trimethylsilylethynyl)benzonitrile |
Description: | 4-[(Trimethylsilyl)ethynyl]benzonitrile (CAS# 75867-40-2) is a useful research chemical. |
Molecular Weight: | 199.32 |
Molecular Formula: | C12H13NSi |
Canonical SMILES: | C[Si](C)(C)C#CC1=CC=C(C=C1)C#N |
InChI: | InChI=1S/C12H13NSi/c1-14(2,3)9-8-11-4-6-12(10-13)7-5-11/h4-7H,1-3H3 |
InChI Key: | WWNSLIBJQBBKKG-UHFFFAOYSA-N |
Boiling Point: | 266.154 °C at 760 mmHg |
Density: | 0.992 g/cm3 |
Appearance: | White to tan powder, crystals or crystalline powder |
LogP: | 2.78718 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111961052-A | Preparation method of gamma-carboline derivative | 20200902 |
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DE-102018201548-A1 | Electrolytic composition for electrochemical cell for high temperature applications | 20180201 |
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Complexity: | 295 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.081725953 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.081725953 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 23.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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