1,3-Benzenediol, 4-(1-phenylethyl)-


Chemical Name: 1,3-Benzenediol, 4-(1-phenylethyl)-
CAS Number: 85-27-8
Product Number: AG004LU8(AGN-PC-0NH2OX)
Synonyms:
MDL No:
Molecular Formula: C14H14O2
Molecular Weight: 214.2598

Identification/Properties


Properties
MP:
79 - 81°C
BP:
365.1±17.0°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
214.264g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
214.099g/mol
Monoisotopic Mass:
214.099g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
211
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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