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4389-53-1 | 2-Hydroxy-6-isopropyl-3-methylbenzoic acid
CAS No: 4389-53-1 Catalog No: AG003HF0 MDL No:
Product Description
Catalog Number:
AG003HF0
Chemical Name:
2-Hydroxy-6-isopropyl-3-methylbenzoic acid
CAS Number:
4389-53-1
IUPAC Name:
2-hydroxy-3-methyl-6-propan-2-ylbenzoic acid
InChI:
InChI=1S/C11H14O3/c1-6(2)8-5-4-7(3)10(12)9(8)11(13)14/h4-6,12H,1-3H3,(H,13,14)
InChI Key:
ZHLQYPNVDAMSFD-UHFFFAOYSA-N
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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