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1072945-04-0 | 2-(4-(Chloromethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1072945-04-0 Catalog No: AG007ESI MDL No:MFCD11053893
Product Description
Catalog Number:
AG007ESI
Chemical Name:
2-(4-(Chloromethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1072945-04-0
Molecular Formula:
C13H18BClO2
Molecular Weight:
252.5448
MDL Number:
MFCD11053893
IUPAC Name:
2-[4-(chloromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BClO2/c1-12(2)13(3,4)17-14(16-12)11-7-5-10(9-15)6-8-11/h5-8H,9H2,1-4H3
InChI Key:
BCRBYHCRLQCNNV-UHFFFAOYSA-N
SMILES:
ClCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
257
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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