3-tert-Butyl-2-hydroxybenzaldehyde - CAS 24623-65-2
Catalog: |
BB018558 |
Product Name: |
3-tert-Butyl-2-hydroxybenzaldehyde |
CAS: |
24623-65-2 |
Synonyms: |
3-tert-butyl-2-hydroxybenzaldehyde |
IUPAC Name: | 3-tert-butyl-2-hydroxybenzaldehyde |
Description: | 3-tert-Butyl-2-hydroxybenzaldehyde (CAS# 24623-65-2) is used in preparation of coumarin derivative. |
Molecular Weight: | 178.23 |
Molecular Formula: | C11H14O2 |
Canonical SMILES: | CC(C)(C)C1=CC=CC(=C1O)C=O |
InChI: | InChI=1S/C11H14O2/c1-11(2,3)9-6-4-5-8(7-12)10(9)13/h4-7,13H,1-3H3 |
InChI Key: | ROILLNJICXGZQQ-UHFFFAOYSA-N |
Boiling Point: | 234.3 °C at 760 mmHg |
Density: | 1.072 g/cm3 |
Appearance: | Colorless to yellow liquid |
MDL: | MFCD00778877 |
LogP: | 2.50220 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, 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-112961194-A | PNO ligand containing chiral ferrocene and application thereof | 20210308 |
CN-213611314-U | Reaction device of covalent organic framework composite material based on photoinitiation | 20201019 |
CN-213951059-U | Reaction device for preparing covalent organic framework through photo-initiation under vacuum condition | 20201019 |
CN-212893929-U | Reaction device for preparing porous nano carbon material based on COFs material | 20200831 |
CN-213160718-U | Device based on continuous distillation preparation is covalence organic frame | 20200831 |
PMID | Publication Date | Title | Journal |
21837152 | 20110701 | 2-tert-Butyl-6-(cyclo-hexyl-imino-meth-yl)-4-meth-oxy-phenol | Acta crystallographica. Section E, Structure reports online |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.099379685 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.099379685 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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