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Home > Boronic Acids > 501014-42-2
501014-42-2 | (Z)-2-(1,2-Diphenylvinyl)-1,3,6,2-dioxazaborocane
CAS No: 501014-42-2 Catalog No: AG003P08 MDL No:
Product Description
Catalog Number:
AG003P08
Chemical Name:
(Z)-2-(1,2-Diphenylvinyl)-1,3,6,2-dioxazaborocane
CAS Number:
501014-42-2
Molecular Formula:
C18H20BNO2
Molecular Weight:
293.1679
IUPAC Name:
2-[(Z)-1,2-diphenylethenyl]-1,3,6,2-dioxazaborocane
InChI:
InChI=1S/C18H20BNO2/c1-3-7-16(8-4-1)15-18(17-9-5-2-6-10-17)19-21-13-11-20-12-14-22-19/h1-10,15,20H,11-14H2/b18-15+
InChI Key:
VMCNVUTVKBCQKB-OBGWFSINSA-N
SMILES:
N1CCOB(OCC1)/C(=C/c1ccccc1)/c1ccccc1
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
293.159g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.173g/mol
Monoisotopic Mass:
293.159g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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