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21022-74-2 | Phenol, 2-methoxy-6-(1-methylethyl)-
CAS No: 21022-74-2 Catalog No: AG002KN8 MDL No:
Product Description
Catalog Number:
AG002KN8
Chemical Name:
Phenol, 2-methoxy-6-(1-methylethyl)-
CAS Number:
21022-74-2
Molecular Formula:
C10H14O2
Molecular Weight:
166.2170
IUPAC Name:
2-methoxy-6-propan-2-ylphenol
InChI:
InChI=1S/C10H14O2/c1-7(2)8-5-4-6-9(12-3)10(8)11/h4-7,11H,1-3H3
InChI Key:
UVWJLHYLMSDQAK-UHFFFAOYSA-N
SMILES:
COc1cccc(c1O)C(C)C
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.099g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.22g/mol
Monoisotopic Mass:
166.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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