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102139-27-5 | Phenol, 4-[1-(4-hydroxy-3-methoxyphenyl)ethyl]-2,6-dimethoxy-
CAS No: 102139-27-5 Catalog No: AG0006PR MDL No:
Product Description
Catalog Number:
AG0006PR
Chemical Name:
Phenol, 4-[1-(4-hydroxy-3-methoxyphenyl)ethyl]-2,6-dimethoxy-
CAS Number:
102139-27-5
Molecular Formula:
C17H20O5
Molecular Weight:
304.3377
IUPAC Name:
4-[1-(4-hydroxy-3-methoxyphenyl)ethyl]-2,6-dimethoxyphenol
InChI:
InChI=1S/C17H20O5/c1-10(11-5-6-13(18)14(7-11)20-2)12-8-15(21-3)17(19)16(9-12)22-4/h5-10,18-19H,1-4H3
InChI Key:
BWXUQUPHOALVFU-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1O)C(c1cc(OC)c(c(c1)OC)O)C
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.131g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
304.342g/mol
Monoisotopic Mass:
304.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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