Text Search
Structure Search

N-(4-butylphenyl)-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

N-(4-butylphenyl)-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: C34H45B2NO4

SMILES: CCCCC1=CC=C(C=C1)N(C1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1)C1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1

IUPAC: N-(4-butylphenyl)-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/C34H45B2NO4/c1-10-11-12-25-13-19-28(20-14-25)37(29-21-15-26(16-22-29)35-38-31(2,3)32(4,5)39-35)30-23-17-27(18-24-30)36-40-33(6,7)34(8,9)41-36/h13-24H,10-12H2,1-9H3

Composition: C (73.80%), H (8.20%), B (3.91%), N (2.53%), O (11.57%)

Molar Mass: 553.36

Atom Count: 86

Heavy Atom Count: 41

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 553.353469
Formal Charge 0
FSP3 0.47
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey MRMUIYADKDRHAA-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 157.37
Topological Polar Surface Area 40.16
Polarizability 65.33
Ring Count 5
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
97% <7 Days C34H45B2NO4 $112.20-$503.03$112.20$190.74$503.03
Request Quote
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C34H45B2NO4 Quote Only