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28636-93-3 | Benzenemethanol, 4-hydroxy-2,6-dimethyl-
CAS No: 28636-93-3 Catalog No: AG002VX9 MDL No:MFCD03411743
Product Description
Catalog Number:
AG002VX9
Chemical Name:
Benzenemethanol, 4-hydroxy-2,6-dimethyl-
CAS Number:
28636-93-3
Molecular Formula:
C9H12O2
Molecular Weight:
152.1904
MDL Number:
MFCD03411743
IUPAC Name:
4-(hydroxymethyl)-3,5-dimethylphenol
InChI:
InChI=1S/C9H12O2/c1-6-3-8(11)4-7(2)9(6)5-10/h3-4,10-11H,5H2,1-2H3
InChI Key:
NUFXUDNVOYVQGI-UHFFFAOYSA-N
SMILES:
OCc1c(C)cc(cc1C)O
Properties
Complexity:
113
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
152.193g/mol
Monoisotopic Mass:
152.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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