Phenol, (1,1-dimethylethyl)-4-methyl-


Chemical Name: Phenol, (1,1-dimethylethyl)-4-methyl-
CAS Number: 2409-55-4
Product Number: AG0033FV(AGN-PC-0JKD7L)
Synonyms:
MDL No:
Molecular Formula: C11H16O
Molecular Weight: 164.2441

Identification/Properties


Properties
MP:
50-52 °C(lit.)
BP:
237°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.4969
Solubility:
methanol: 0.1 g/mL, clear
Computed Properties
Molecular Weight:
164.248g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
164.12g/mol
Monoisotopic Mass:
164.12g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
146
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-H411
Precautionary Statements:
P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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