3-Nitro-6-[2-(trimethylsilyl)ethoxy]pyridine-2-acetonitrile - CAS 361456-00-0
Catalog: |
BB022880 |
Product Name: |
3-Nitro-6-[2-(trimethylsilyl)ethoxy]pyridine-2-acetonitrile |
CAS: |
361456-00-0 |
Synonyms: |
2-[3-nitro-6-(2-trimethylsilylethoxy)pyridin-2-yl]acetonitrile |
IUPAC Name: | 2-[3-nitro-6-(2-trimethylsilylethoxy)pyridin-2-yl]acetonitrile |
Description: | 3-Nitro-6-[2-(trimethylsilyl)ethoxy]pyridine-2-acetonitrile (CAS# 361456-00-0 ) is a useful research chemical. |
Molecular Weight: | 279.37 |
Molecular Formula: | C12H17N3O3Si |
Canonical SMILES: | C[Si](C)(C)CCOC1=NC(=C(C=C1)[N+](=O)[O-])CC#N |
InChI: | InChI=1S/C12H17N3O3Si/c1-19(2,3)9-8-18-12-5-4-11(15(16)17)10(14-12)6-7-13/h4-5H,6,8-9H2,1-3H3 |
InChI Key: | ZELXOZMZOFEIFO-UHFFFAOYSA-N |
LogP: | 3.29608 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 |
Signal Word: | Danger |
Complexity: | 356 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 279.10391795 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 279.10391795 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 91.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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