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Home > Boronic Acids > 114027-14-4
114027-14-4 | 1H-Tetrazaborole, 4,5-dihydro-1-methyl-4,5-diphenyl-
CAS No: 114027-14-4 Catalog No: AG000ACU MDL No:
Product Description
Catalog Number:
AG000ACU
Chemical Name:
1H-Tetrazaborole, 4,5-dihydro-1-methyl-4,5-diphenyl-
CAS Number:
114027-14-4
Molecular Formula:
C13H13BN4
Molecular Weight:
236.0801
IUPAC Name:
1-methyl-4,5-diphenyltetrazaborole
InChI:
InChI=1S/C13H13BN4/c1-17-14(12-8-4-2-5-9-12)18(16-15-17)13-10-6-3-7-11-13/h2-11H,1H3
InChI Key:
WSNWUQGJDDLMOJ-UHFFFAOYSA-N
SMILES:
CN1N=NN(B1c1ccccc1)c1ccccc1
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.123g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.085g/mol
Monoisotopic Mass:
236.123g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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