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7622-93-7 | 5-Benzofuranol, 6-(1,1-dimethylethyl)-2,3-dihydro-2,2-dimethyl-
CAS No: 7622-93-7 Catalog No: AG00574B MDL No:
Product Description
Catalog Number:
AG00574B
Chemical Name:
5-Benzofuranol, 6-(1,1-dimethylethyl)-2,3-dihydro-2,2-dimethyl-
CAS Number:
7622-93-7
Molecular Formula:
C14H20O2
Molecular Weight:
220.3074
IUPAC Name:
6-tert-butyl-2,2-dimethyl-3H-1-benzofuran-5-ol
InChI:
InChI=1S/C14H20O2/c1-13(2,3)10-7-12-9(6-11(10)15)8-14(4,5)16-12/h6-7,15H,8H2,1-5H3
InChI Key:
UGAZGXGAIAGBMP-UHFFFAOYSA-N
SMILES:
Oc1cc2CC(Oc2cc1C(C)(C)C)(C)C
UNII:
C955DH232W
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.146g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.312g/mol
Monoisotopic Mass:
220.146g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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