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Home > Other Heterocycles > 113668-55-6
113668-55-6 | 7-Borabicyclo[2.2.1]hept-2-ene, 1,2,3,4-tetramethyl-7-phenyl-
CAS No: 113668-55-6 Catalog No: AG00099M MDL No:
Product Description
Catalog Number:
AG00099M
Chemical Name:
7-Borabicyclo[2.2.1]hept-2-ene, 1,2,3,4-tetramethyl-7-phenyl-
CAS Number:
113668-55-6
Molecular Formula:
C16H21B
Molecular Weight:
224.1489
IUPAC Name:
1,2,3,4-tetramethyl-7-phenyl-7-borabicyclo[2.2.1]hept-2-ene
InChI:
InChI=1S/C16H21B/c1-12-13(2)16(4)11-10-15(12,3)17(16)14-8-6-5-7-9-14/h5-9H,10-11H2,1-4H3
InChI Key:
JWQGELKCCRPNGU-UHFFFAOYSA-N
SMILES:
CC1=C(C)C2(B(C1(C)CC2)c1ccccc1)C
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.174g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.154g/mol
Monoisotopic Mass:
224.174g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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