1,3-Benzenediol, methyl-


Chemical Name: 1,3-Benzenediol, methyl-
CAS Number: 608-25-3
Product Number: AG003HQK(AGN-PC-0JKA95)
Synonyms:
MDL No:
Molecular Formula: C7H8O2
Molecular Weight: 124.1372

Identification/Properties


Properties
MP:
114-120 °C(lit.)
BP:
282.1°C at 760 mmHg
Storage:
Light sensitive;Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
1.4922 (estimate)
Solubility:
263g/l
Computed Properties
Molecular Weight:
124.139g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
124.052g/mol
Monoisotopic Mass:
124.052g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
82.9
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


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301-H315-H319
Precautionary Statements:
P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P310+P330-P405
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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