4-tert-Butylbenzoyl chloride - CAS 1710-98-1
Catalog: |
BB012715 |
Product Name: |
4-tert-Butylbenzoyl chloride |
CAS: |
1710-98-1 |
Synonyms: |
4-tert-butylbenzoyl chloride |
IUPAC Name: | 4-tert-butylbenzoyl chloride |
Description: | 4-tert-Butylbenzoyl chloride (CAS# 1710-98-1) is used as a reactant in the preparation of multi-branched structures based on triphenylamine for enhanced two-photon absorption. |
Molecular Weight: | 196.67 |
Molecular Formula: | C11H13ClO |
Canonical SMILES: | CC(C)(C)C1=CC=C(C=C1)C(=O)Cl |
InChI: | InChI=1S/C11H13ClO/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3 |
InChI Key: | WNLMYNASWOULQY-UHFFFAOYSA-N |
Boiling Point: | 135 °C (20 torr) |
Purity: | 95 % |
Density: | 1.007 g/cm3 |
Appearance: | Clear colourless to very slightly yellow liquid |
Storage: | Corrosives area. |
MDL: | MFCD00000695 |
LogP: | 3.36310 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112280025-A | High-stability quantum dot hybrid nanostructure, QLED device and preparation method thereof | 20201230 |
CN-112280025-B | High-stability quantum dot hybrid nanostructure, QLED device and preparation method thereof | 20201230 |
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Complexity: | 185 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.0654927 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.0654927 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.8 |
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