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195062-59-0 | 2-METHYLPHENYLBORONIC ACID, PINACOL ESTER
CAS No: 195062-59-0 Catalog No: AG00APVR MDL No:MFCD06795658
Product Description
Catalog Number:
AG00APVR
Chemical Name:
2-METHYLPHENYLBORONIC ACID, PINACOL ESTER
CAS Number:
195062-59-0
Molecular Formula:
C13H19BO2
Molecular Weight:
218.0998
MDL Number:
MFCD06795658
IUPAC Name:
4,4,5,5-tetramethyl-2-(2-methylphenyl)-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H19BO2/c1-10-8-6-7-9-11(10)14-15-12(2,3)13(4,5)16-14/h6-9H,1-5H3
InChI Key:
NUFSJKMRPYGNHV-UHFFFAOYSA-N
SMILES:
Cc1ccccc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.148g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.103g/mol
Monoisotopic Mass:
218.148g/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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