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Home > Boronic Acids > 1005010-03-6
1005010-03-6 | 2-BENZYLOXY-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ANISOLE
CAS No: 1005010-03-6 Catalog No: AG00958I MDL No:MFCD05663840
Product Description
Catalog Number:
AG00958I
Chemical Name:
2-BENZYLOXY-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ANISOLE
CAS Number:
1005010-03-6
Molecular Formula:
C20H25BO4
Molecular Weight:
340.2211
MDL Number:
MFCD05663840
IUPAC Name:
2-(4-methoxy-3-phenylmethoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C20H25BO4/c1-19(2)20(3,4)25-21(24-19)16-11-12-17(22-5)18(13-16)23-14-15-9-7-6-8-10-15/h6-13H,14H2,1-5H3
InChI Key:
PNAPHEUGEGSIJQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OCc1ccccc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.185g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.226g/mol
Monoisotopic Mass:
340.185g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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