Cas no 88174-38-3 (Benzaldehyde, 6-bromo-2,3,4-trimethyl-)
88174-38-3 structure
Product Name:Benzaldehyde, 6-bromo-2,3,4-trimethyl-
CAS No:88174-38-3
MF:C10H11BrO
MW:227.097742319107
CID:642222
PubChem ID:13827191
Update Time:2025-04-19
Benzaldehyde, 6-bromo-2,3,4-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde, 6-bromo-2,3,4-trimethyl-
- 6-bromo-2,3,4-trimethylbenzaldehyde
- SCHEMBL12689899
- DTXSID40550579
- 88174-38-3
-
- Inchi： 1S/C10H11BrO/c1-6-4-10(11)9(5-12)8(3)7(6)2/h4-5H,1-3H3
- InChI Key： LOUGDZGNVLFKIR-UHFFFAOYSA-N
- SMILES： BrC1C=C(C)C(C)=C(C)C=1C=O
Computed Properties
- Exact Mass: 225.99933g/mol
- Monoisotopic Mass: 225.99933g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 169
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 17.1?2
Benzaldehyde, 6-bromo-2,3,4-trimethyl- Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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