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Home > Boronic Acids > 517920-59-1
517920-59-1 | 2-[(3-chlorophenyl)Methyl]-4,4,5,5-tetraMethyl-1,3,2-dioxaborolane
CAS No: 517920-59-1 Catalog No: AG00DL31 MDL No:MFCD10698516
Product Description
Catalog Number:
AG00DL31
Chemical Name:
2-[(3-chlorophenyl)Methyl]-4,4,5,5-tetraMethyl-1,3,2-dioxaborolane
CAS Number:
517920-59-1
Molecular Formula:
C13H18BClO2
Molecular Weight:
252.5448
MDL Number:
MFCD10698516
IUPAC Name:
2-[(3-chlorophenyl)methyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BClO2/c1-12(2)13(3,4)17-14(16-12)9-10-6-5-7-11(15)8-10/h5-8H,9H2,1-4H3
InChI Key:
HSRXSXFASWKTMZ-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)CB1OC(C(O1)(C)C)(C)C
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.109g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.545g/mol
Monoisotopic Mass:
252.109g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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