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141522-24-9 | 1,3,2-Dioxaborinane, 2-(2,4,6-trimethylphenyl)-
CAS No: 141522-24-9 Catalog No: AG001GIL MDL No:
Product Description
Catalog Number:
AG001GIL
Chemical Name:
1,3,2-Dioxaborinane, 2-(2,4,6-trimethylphenyl)-
CAS Number:
141522-24-9
Molecular Formula:
C12H17BO2
Molecular Weight:
204.0732
IUPAC Name:
2-(2,4,6-trimethylphenyl)-1,3,2-dioxaborinane
InChI:
InChI=1S/C12H17BO2/c1-9-7-10(2)12(11(3)8-9)13-14-5-4-6-15-13/h7-8H,4-6H2,1-3H3
InChI Key:
FTCXIHWTOOBXSG-UHFFFAOYSA-N
SMILES:
Cc1cc(C)cc(c1B1OCCCO1)C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.132g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.076g/mol
Monoisotopic Mass:
204.132g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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