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4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline

4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline

Formula: C24H33B2NO4

SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(NC2=CC=C(C=C2)B2OC(C)(C)C(C)(C)O2)C=C1

IUPAC: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline

InChI: InChI=1S/C24H33B2NO4/c1-21(2)22(3,4)29-25(28-21)17-9-13-19(14-10-17)27-20-15-11-18(12-16-20)26-30-23(5,6)24(7,8)31-26/h9-16,27H,1-8H3

Composition: C (68.45%), H (7.90%), B (5.13%), N (3.33%), O (15.20%)

Molar Mass: 421.15

Atom Count: 64

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 421.259569
Formal Charge 0
FSP3 0.5
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey OCOXSASWGGEHJJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 113.85
Topological Polar Surface Area 48.95
Polarizability 48.42
Ring Count 4
Rotatable Bond Count 4

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Purity (%)
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Purity LeadTime Formula UnitPrice
98% <10 Days C24H33B2NO4 Quote Only