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115546-31-1 | Benzenepropanol, 2-hydroxy-4,5-dimethoxy-
CAS No: 115546-31-1 Catalog No: AG000G4F MDL No:
Product Description
Catalog Number:
AG000G4F
Chemical Name:
Benzenepropanol, 2-hydroxy-4,5-dimethoxy-
CAS Number:
115546-31-1
Molecular Formula:
C11H16O4
Molecular Weight:
212.2423
IUPAC Name:
2-(3-hydroxypropyl)-4,5-dimethoxyphenol
InChI:
InChI=1S/C11H16O4/c1-14-10-6-8(4-3-5-12)9(13)7-11(10)15-2/h6-7,12-13H,3-5H2,1-2H3
InChI Key:
MIOCMAOGMCABCF-UHFFFAOYSA-N
SMILES:
OCCCc1cc(OC)c(cc1O)OC
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.245g/mol
Monoisotopic Mass:
212.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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