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Home > Boronic Acids > 853998-14-8
853998-14-8 | 4,4,5,5-tetramethyl-2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,2-dioxaborolane
CAS No: 853998-14-8 Catalog No: AG01DJS8 MDL No:MFCD27956013
Product Description
Catalog Number:
AG01DJS8
Chemical Name:
4,4,5,5-tetramethyl-2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,2-dioxaborolane
CAS Number:
853998-14-8
Molecular Formula:
C20H31BO2
Molecular Weight:
314.2699
MDL Number:
MFCD27956013
IUPAC Name:
4,4,5,5-tetramethyl-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3,2-dioxaborolane
InChI:
InChI=1S/C20H31BO2/c1-17(2)11-12-18(3,4)16-13-14(9-10-15(16)17)21-22-19(5,6)20(7,8)23-21/h9-10,13H,11-12H2,1-8H3
InChI Key:
FUSVGFZGSVYZAI-UHFFFAOYSA-N
SMILES:
CC1(C)CCC(c2c1ccc(c2)B1OC(C(O1)(C)C)(C)C)(C)C
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.242g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.276g/mol
Monoisotopic Mass:
314.242g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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