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4,4,5,5-tetramethyl-2-[(4-methylphenyl)methyl]-1,3,2-dioxaborolane

4,4,5,5-tetramethyl-2-[(4-methylphenyl)methyl]-1,3,2-dioxaborolane

CAS: 356570-52-0

Formula: C14H21BO2

SMILES: CC1=CC=C(CB2OC(C)(C)C(C)(C)O2)C=C1

IUPAC: 4,4,5,5-tetramethyl-2-[(4-methylphenyl)methyl]-1,3,2-dioxaborolane

InChI: InChI=1S/C14H21BO2/c1-11-6-8-12(9-7-11)10-15-16-13(2,3)14(4,5)17-15/h6-9H,10H2,1-5H3

Composition: C (72.44%), H (9.12%), B (4.66%), O (13.78%)

Molar Mass: 232.13

Atom Count: 38

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 232.16346
Formal Charge 0
FSP3 0.57
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey IRKUSKILEFQOJQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.76
Topological Polar Surface Area 18.46
Polarizability 27.65
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
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