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1029439-70-0

1029439-70-0 | 3-Chloro-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenol

CAS No: 1029439-70-0 Catalog No: AG00947M MDL No:MFCD16994424

Product Description

Catalog Number:
AG00947M
Chemical Name:
3-Chloro-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenol
CAS Number:
1029439-70-0
Molecular Formula:
C12H16BClO3
Molecular Weight:
254.5176
MDL Number:
MFCD16994424
IUPAC Name:
3-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
InChI:
InChI=1S/C12H16BClO3/c1-11(2)12(3,4)17-13(16-11)9-6-5-8(15)7-10(9)14/h5-7,15H,1-4H3
InChI Key:
GVRXANKNFVXVMH-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)Cl)B1OC(C(O1)(C)C)(C)C

Properties

Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.088g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.517g/mol
Monoisotopic Mass:
254.088g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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