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4,4′-Bis(diethylamino)benzophenone - 99%, high purity , CAS No.90-93-7
Basic Description
Synonyms
B1275 | BIDD:GT0818 | EN300-6760066 | 4,4/'-Bis(diethylamino)benzophenone | NSC 36365 | 4,4'-Bis(diethylamino)benzophenone, >=99% | 4,4'-Bis(diethylamino)benzophenone, 99% | AC-11741 | 4,4'-Di(N,N-diethylamino)benzophenone | SR-01000389294 | 4,N-diethylam
Specifications & Purity
≥99%
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzophenones
Intermediate Tree Nodes
Not available
Direct Parent
Benzophenones
Alternative Parents
Diphenylmethanes Aryl-phenylketones Dialkylarylamines Benzoyl derivatives Aniline and substituted anilines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzophenone - Diphenylmethane - Aryl-phenylketone - Benzoyl - Tertiary aliphatic/aromatic amine - Aryl ketone - Aniline or substituted anilines - Dialkylarylamine - Ketone - Tertiary amine - Organic oxide - Organooxygen compound - Organonitrogen compound - Amine - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
Pubchem Sid
488183826
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488183826
IUPAC Name
bis[4-(diethylamino)phenyl]methanone
INCHI
InChI=1S/C21H28N2O/c1-5-22(6-2)19-13-9-17(10-14-19)21(24)18-11-15-20(16-12-18)23(7-3)8-4/h9-16H,5-8H2,1-4H3
InChIKey
VYHBFRJRBHMIQZ-UHFFFAOYSA-N
Smiles
CCN(CC)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N(CC)CC
Isomeric SMILES
CCN(CC)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N(CC)CC
WGK Germany
2
RTECS
OS9545500
Molecular Weight
324.46
Beilstein
2148611
Reaxy-Rn
2148611
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2148611&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Solubility in water: 0.1 mg/l 20 °C; Soluble in Methanol
Sensitivity
Light sensitive.
Flash Point(°C)
151 °C
Melt Point(°C)
89-92°C
Molecular Weight
324.500 g/mol
XLogP3
5.300
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
8
Exact Mass
324.22 Da
Monoisotopic Mass
324.22 Da
Topological Polar Surface Area
23.600 Ų
Heavy Atom Count
24
Formal Charge
0
Complexity
326.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
Citations of This Product
1.
Jinxiu Hu, Xianlong Liu, Yi Liu, Kang Xue, Chengxiang Shi, Xiangwen Zhang, Li Wang, Ji-Jun Zou, Lun Pan.
(2023)
Photoinduced transposed Paternò-Büchi reaction for effective synthesis of high-performance jet fuel.
CHINESE JOURNAL OF CHEMICAL ENGINEERING,
2.
Juan Zhang, Bingrui Liu, Chao Chen, Shaojun Jiang, Yiyuan Zhang, Bing Xu, Ang Li, Junchao Xu, Dawei Wang, Leran Zhang, Yanlei Hu, Jiawen Li, Dong Wu, Jiaru Chu, Zuojun Shen.
(2022)
Ultrafast Laser-Ablated Bioinspired Hydrogel-Based Porous Gating System for Sustained Drug Release.
ACS Applied Materials & Interfaces,
14
(31):
(35366–35375).
3.
Yi Liu, Ying Chen, Shuang Ma, Xianlong Liu, Xiangwen Zhang, Ji-Jun Zou, Lun Pan.
(2022)
Synthesis of advanced fuel with density higher than 1 g/mL by photoinduced [2 + 2] cycloaddition of norbornene.
FUEL,
318
(123629).
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