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[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl carbonochloridate

[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl carbonochloridate

Formula: C14H18BClO4

SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(COC(Cl)=O)C=C1

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

InChI: InChI=1S/C14H18BClO4/c1-13(2)14(3,4)20-15(19-13)11-7-5-10(6-8-11)9-18-12(16)17/h5-8H,9H2,1-4H3

Composition: C (56.70%), H (6.12%), B (3.65%), Cl (11.95%), O (21.58%)

Molar Mass: 296.55

Atom Count: 38

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 296.098667
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey RRWXWRCAEZWWCE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.39
Topological Polar Surface Area 44.76
Polarizability 30.33
Ring Count 2
Rotatable Bond Count 4

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Purity (%)
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C14H18BClO4 Quote Only