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Home > Boronic Acids > 193905-93-0

193905-93-0

193905-93-0 | (3-(tert-Butyl)-5-methylphenyl)boronic acid

CAS No: 193905-93-0 Catalog No: AG00387I MDL No:MFCD03411938

Product Description

Catalog Number:
AG00387I
Chemical Name:
(3-(tert-Butyl)-5-methylphenyl)boronic acid
CAS Number:
193905-93-0
Molecular Formula:
C11H17BO2
Molecular Weight:
192.0625
MDL Number:
MFCD03411938
IUPAC Name:
(3-tert-butyl-5-methylphenyl)boronic acid
InChI:
InChI=1S/C11H17BO2/c1-8-5-9(11(2,3)4)7-10(6-8)12(13)14/h5-7,13-14H,1-4H3
InChI Key:
XWWPIVKWAIMBMU-UHFFFAOYSA-N
SMILES:
Cc1cc(cc(c1)C(C)(C)C)B(O)O

Properties

Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.132g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
192.065g/mol
Monoisotopic Mass:
192.132g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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