4-Hexylaniline - CAS 33228-45-4
Catalog: |
BB021618 |
Product Name: |
4-Hexylaniline |
CAS: |
33228-45-4 |
Synonyms: |
4-hexylaniline |
IUPAC Name: | 4-hexylaniline |
Description: | 4-Hexylaniline (CAS# 33228-45-4) is a useful research chemical. |
Molecular Weight: | 177.29 |
Molecular Formula: | C12H19N |
Canonical SMILES: | CCCCCCC1=CC=C(C=C1)N |
InChI: | InChI=1S/C12H19N/c1-2-3-4-5-6-11-7-9-12(13)10-8-11/h7-10H,2-6,13H2,1H3 |
InChI Key: | OVEMTTZEBOCJDV-UHFFFAOYSA-N |
Boiling Point: | 279-285 °C |
Purity: | 95 % |
Density: | 0.919 g/mL at 25°C(lit.) |
Appearance: | Light yellow to tan-brown liquid, aromatic amine odor |
MDL: | MFCD00007927 |
LogP: | 3.97280 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-20210023952-A | Compounds comprising benzophenone group, Organic electronic device comprising organic layers comprising the photo-cured of the monomer compounds | 20210224 |
CN-112679532-A | Boron-nitrogen-benzene shunt thiophene derivative, conjugated high-molecular polymer, preparation method of conjugated high-molecular polymer and application of conjugated high-molecular polymer in fluorine ion detection | 20201111 |
CN-112679532-B | Boron-nitrogen-benzene shunt thiophene derivative, conjugated high-molecular polymer, preparation method of conjugated high-molecular polymer and application of conjugated high-molecular polymer in fluorine ion detection | 20201111 |
EP-3901704-A1 | Photoresponsive material, adhesive, optical switching material, toner, and image forming method | 20200424 |
US-2021332272-A1 | Photoresponsive material, adhesive, optical switching material, toner, and image forming method | 20200424 |
PMID | Publication Date | Title | Journal |
15975246 | 20050501 | Evaluation of a capillary gas chromatographic impurity test procedure for 4-hexylaniline | Journal of chromatographic science |
Complexity: | 114 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.151749610 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.151749610 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.9 |
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