1,3-Benzenediol, 5-pentyl-


Chemical Name: 1,3-Benzenediol, 5-pentyl-
CAS Number: 500-66-3
Product Number: AG0035FJ(AGN-PC-00619C)
Synonyms:
MDL No:
Molecular Formula: C11H16O2
Molecular Weight: 180.2435

Identification/Properties


Properties
MP:
46-48 °C(lit.);
BP:
313.3°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
180.247g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
180.115g/mol
Monoisotopic Mass:
180.115g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
126
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback