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Home > Boronic Acids > 1280078-62-7
1280078-62-7 | 4-(1,3,6,2-Dioxazaborocan-2-yl)benzonitrile
CAS No: 1280078-62-7 Catalog No: AG00HRR7 MDL No:
Product Description
Catalog Number:
AG00HRR7
Chemical Name:
4-(1,3,6,2-Dioxazaborocan-2-yl)benzonitrile
CAS Number:
1280078-62-7
IUPAC Name:
4-(1,3,6,2-dioxazaborocan-2-yl)benzonitrile
InChI:
InChI=1S/C11H13BN2O2/c13-9-10-1-3-11(4-2-10)12-15-7-5-14-6-8-16-12/h1-4,14H,5-8H2
InChI Key:
WQHLDUPDKWDOJD-UHFFFAOYSA-N
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.107g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.047g/mol
Monoisotopic Mass:
216.107g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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