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863578-21-6

863578-21-6 | 5-Chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);aniline

CAS No: 863578-21-6 Catalog No: AG004PZX MDL No:MFCD11617915

Product Description

Catalog Number:
AG004PZX
Chemical Name:
5-Chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);aniline
CAS Number:
863578-21-6
Molecular Formula:
C12H17BClNO2
Molecular Weight:
253.5329
MDL Number:
MFCD11617915
IUPAC Name:
5-chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
InChI:
InChI=1S/C12H17BClNO2/c1-11(2)12(3,4)17-13(16-11)9-6-5-8(14)7-10(9)15/h5-7H,15H2,1-4H3
InChI Key:
ZEZOXGCBIPAXOT-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)N)B1OC(C(O1)(C)C)(C)C

Properties

Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.104g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.533g/mol
Monoisotopic Mass:
253.104g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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