4,4,5,5-tetramethyl-2-[(E)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-en-2-yl]-1,3,2-dioxaborolane

Formula:C18H34O4B2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4,4,5,5-tetramethyl-2-[(E)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-en-2-yl]-1,3,2-dioxaborolane is a drug-like molecule.

MolName	4,4,5,5-tetramethyl-2-[(E)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-en-2-yl]-1,3,2-dioxaborolane
MolecularFormula	C18H34O4B2
Smiles	CCCC/C(/B1OC(C)(C)C(C)(C)O1)=C/B1OC(C)(C)C(C)(C)O1
InChI	InChI=1S/C18H34B2O4/c1-10-11-12-14(20-23-17(6,7)18(8,9)24-20)13-19-21-15(2,3)16(4,5)22-19/h13H,10-12H2,1-9H3
InChIK	SACOFNGKSPZAFQ-UHFFFAOYSA-N
TotalMolweight	336.086
Molweight	336.086
MonoisotopicMass	336.26432
CLogP	3.2574
CLogS	-1.059
H Acceptors	4
TotalSurfaceArea	273.67
Relative PSA	0.14616
PolarSurfaceArea	36.92
Druglikeness	-26.313
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	unwanted atom
Shape Index	0.41667
Fragments	1
Non HAtoms	24
NonCHAtoms	6
Electronegative Atoms	4
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Sp3Atoms	20
Symmetricatoms	10
StereoCon

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1 - 4,4,5,5-tetramethyl-2-[(E)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-en-2-yl]-1,3,2-dioxaborolane | 2 - 4,4,5,5-tetramethyl-2-[(E)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-en-2-yl]-1,3,2-dioxaborolane

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