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675605-91-1 | 3-(METHOXYMETHYL)PHENYLBORONIC ACID, PINACOL ESTER
CAS No: 675605-91-1 Catalog No: AG00FB90 MDL No:MFCD06795646
Product Description
Catalog Number:
AG00FB90
Chemical Name:
3-(METHOXYMETHYL)PHENYLBORONIC ACID, PINACOL ESTER
CAS Number:
675605-91-1
Molecular Formula:
C14H21BO3
Molecular Weight:
248.1257
MDL Number:
MFCD06795646
IUPAC Name:
2-[3-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H21BO3/c1-13(2)14(3,4)18-15(17-13)12-8-6-7-11(9-12)10-16-5/h6-9H,10H2,1-5H3
InChI Key:
FDTVLJCTUKZTMS-UHFFFAOYSA-N
SMILES:
COCc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.129g/mol
Monoisotopic Mass:
248.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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