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

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

CAS: 1251732-64-5

Formula: C17H30BNO4

SMILES: CC(C)(C)OC(=O)NC1CCC(=CC1)B1OC(C)(C)C(C)(C)O1

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

InChI: InChI=1/C17H30BNO4/c1-15(2,3)21-14(20)19-13-10-8-12(9-11-13)18-22-16(4,5)17(6,7)23-18/h8,13H,9-11H2,1-7H3,(H,19,20)

Composition: C (63.17%), H (9.36%), B (3.34%), N (4.33%), O (19.80%)

Molar Mass: 323.24

Atom Count: 53

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	323.226788
Formal Charge	0
FSP3	0.82
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	BQDDQHLYCAQNMX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.49
Topological Polar Surface Area	56.79
Polarizability	35.61
Ring Count	2
Rotatable Bond Count	4

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