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Home > Other Heterocycles > 67753-90-6
67753-90-6 | 9-BORABICYCLO[3.3.1]NONANE, 9-(2-PHENYLETHYL)-
CAS No: 67753-90-6 Catalog No: AG006JUX MDL No:
Product Description
Catalog Number:
AG006JUX
Chemical Name:
9-BORABICYCLO[3.3.1]NONANE, 9-(2-PHENYLETHYL)-
CAS Number:
67753-90-6
Molecular Formula:
C16H23B
Molecular Weight:
226.1648
IUPAC Name:
9-(2-phenylethyl)-9-borabicyclo[3.3.1]nonane
InChI:
InChI=1S/C16H23B/c1-2-6-14(7-3-1)12-13-17-15-8-4-9-16(17)11-5-10-15/h1-3,6-7,15-16H,4-5,8-13H2
InChI Key:
WXQKBHANEQHARQ-UHFFFAOYSA-N
SMILES:
C1CC2CCCC(C1)B2CCc1ccccc1
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.189g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.17g/mol
Monoisotopic Mass:
226.189g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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