2-tert-Butyl-1,1,3,3-tetramethylguanidine - CAS 29166-72-1
Catalog: |
BB020113 |
Product Name: |
2-tert-Butyl-1,1,3,3-tetramethylguanidine |
CAS: |
29166-72-1 |
Synonyms: |
2-tert-butyl-1,1,3,3-tetramethylguanidine |
IUPAC Name: | 2-tert-butyl-1,1,3,3-tetramethylguanidine |
Description: | 2-tert-Butyl-1,1,3,3-tetramethylguanidine (CAS# 29166-72-1) is an excellent alternative to traditional inorganic bases for promoting the coupling reaction. |
Molecular Weight: | 171.28 |
Molecular Formula: | C9H21N3 |
Canonical SMILES: | CC(C)(C)N=C(N(C)C)N(C)C |
InChI: | InChI=1S/C9H21N3/c1-9(2,3)10-8(11(4)5)12(6)7/h1-7H3 |
InChI Key: | YQHJFPFNGVDEDT-UHFFFAOYSA-N |
Boiling Point: | 88-89 °C43 mmHg (lit.) |
Purity: | 98 % |
Density: | 0.84 g/cm3 |
MDL: | MFCD01862972 |
LogP: | 1.26410 |
GHS Hazard Statement: | H227 (25%): Combustible liquid [Warning Flammable liquids] |
Precautionary Statement: | P210, P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P370+P378, P403+P235, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
12659597 | 20030403 | Synthesis of highly oxygenated dinaphthyl ethers via SNAr reactions promoted by Barton's base | Organic letters |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.173547683 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.173547683 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 18.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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