Home Other Building Blocks 6-tert-butyl-2-fluoro-3-methylphenol

6-tert-butyl-2-fluoro-3-methylphenol

CAS No.:
133342-44-6
Catalog Number:
AG01AV2D
Molecular Formula:
C11H15FO
Molecular Weight:
182.2346
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Product Description
Catalog Number:
AG01AV2D
Chemical Name:
6-tert-butyl-2-fluoro-3-methylphenol
CAS Number:
133342-44-6
Molecular Formula:
C11H15FO
Molecular Weight:
182.2346
MDL Number:
MFCD24725378
IUPAC Name:
6-tert-butyl-2-fluoro-3-methylphenol
InChI:
InChI=1S/C11H15FO/c1-7-5-6-8(11(2,3)4)10(13)9(7)12/h5-6,13H,1-4H3
InChI Key:
PSUMWEOGUPTPMD-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1F)O)C(C)(C)C
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.111g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.238g/mol
Monoisotopic Mass:
182.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties