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115483-15-3 | 5-Benzofuranol, 4-(1,1-dimethylethyl)-
CAS No: 115483-15-3 Catalog No: AG000G1P MDL No:
Product Description
Catalog Number:
AG000G1P
Chemical Name:
5-Benzofuranol, 4-(1,1-dimethylethyl)-
CAS Number:
115483-15-3
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
IUPAC Name:
4-tert-butyl-1-benzofuran-5-ol
InChI:
InChI=1S/C12H14O2/c1-12(2,3)11-8-6-7-14-10(8)5-4-9(11)13/h4-7,13H,1-3H3
InChI Key:
GIAVFPKZFUTDJT-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1C(C)(C)C)cco2
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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