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tert-butyl N-methyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-en-1-yl]carbamate

tert-butyl N-methyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-en-1-yl]carbamate

CAS: 1572399-64-4

Formula: C18H32BNO4

SMILES: CN(C1CCC(=CC1)B1OC(C)(C)C(C)(C)O1)C(=O)OC(C)(C)C

IUPAC: tert-butyl N-methyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-en-1-yl]carbamate

InChI: InChI=1/C18H32BNO4/c1-16(2,3)22-15(21)20(8)14-11-9-13(10-12-14)19-23-17(4,5)18(6,7)24-19/h9,14H,10-12H2,1-8H3

Composition: C (64.10%), H (9.56%), B (3.21%), N (4.15%), O (18.97%)

Molar Mass: 337.27

Atom Count: 56

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 337.242439
Formal Charge 0
FSP3 0.83
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey BWSRPHKNNQXJFZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 91.39
Topological Polar Surface Area 48
Polarizability 37.45
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 1572399-64-4 $276.16-$1,138.68$276.16$442.61$759.12$1,138.68
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