Cas no 627526-41-4 (1,3,2-DIOXABOROLANE, 4,4,5,5-TETRAMETHYL-2-(4-METHYL-2-NAPHTHALENYL)-)
627526-41-4 structure
Product Name:1,3,2-DIOXABOROLANE, 4,4,5,5-TETRAMETHYL-2-(4-METHYL-2-NAPHTHALENYL)-
CAS No:627526-41-4
MF:C17H21BO2
MW:268.158445119858
CID:3183619
PubChem ID:22240161
Update Time:2025-04-21
1,3,2-DIOXABOROLANE, 4,4,5,5-TETRAMETHYL-2-(4-METHYL-2-NAPHTHALENYL)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3,2-DIOXABOROLANE, 4,4,5,5-TETRAMETHYL-2-(4-METHYL-2-NAPHTHALENYL)-
- NWDPTQJFZMUZAC-UHFFFAOYSA-N
- 4,4,5,5-tetramethyl-2-(4-methyl-naphthalen-2-yl)-[1,3,2]dioxaborolane
- 627526-41-4
- SCHEMBL5782260
- 4,4,5,5-tetramethyl-2-(4-methylnaphthalen-2-yl)-1,3,2-dioxaborolane
-
- Inchi： 1S/C17H21BO2/c1-12-10-14(11-13-8-6-7-9-15(12)13)18-19-16(2,3)17(4,5)20-18/h6-11H,1-5H3
- InChI Key： NWDPTQJFZMUZAC-UHFFFAOYSA-N
- SMILES： O1B(C2C=C(C)C3C=CC=CC=3C=2)OC(C)(C)C1(C)C
Computed Properties
- Exact Mass: 268.1634601Da
- Monoisotopic Mass: 268.1634601Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 350
- 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
- Topological Polar Surface Area: 18.5?2
1,3,2-DIOXABOROLANE, 4,4,5,5-TETRAMETHYL-2-(4-METHYL-2-NAPHTHALENYL)- Related Literature
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Somenath Panda,Kaushik Kundu,Anusha Basaiahgari,Sanjib Senapati,Ramesh L. Gardas New J. Chem., 2018,42, 7105-7118
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