Phenol, 3,4,5-trimethyl-


Chemical Name: Phenol, 3,4,5-trimethyl-
CAS Number: 527-54-8
Product Number: AG003IF5(AGN-PC-0JK9NO)
Synonyms:
MDL No:
Molecular Formula: C9H12O
Molecular Weight: 136.19098

Identification/Properties


Properties
MP:
94-98 °C
BP:
251.8°C
Form:
Solid
Refractive Index:
1.5084 (estimate)
Computed Properties
Molecular Weight:
136.194g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
136.089g/mol
Monoisotopic Mass:
136.089g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
99.3
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#:
2430
Hazard Statements:
H314
Precautionary Statements:
P264-P280-P301+P330+P331-P303+P361+P353-P304+P340+P310-P305+P351+P338+P310-P363-P405-P501
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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