Benzeneacetic acid, 4-(1,1-dimethylethyl)-


Chemical Name: Benzeneacetic acid, 4-(1,1-dimethylethyl)-
CAS Number: 32857-63-9
Product Number: AG00345F(AGN-PC-0JLLRW)
Synonyms:
MDL No: MFCD00082593
Molecular Formula: C12H16O2
Molecular Weight: 192.2542

Identification/Properties


Properties
MP:
77-78 °C
BP:
302.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
192.258g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
192.115g/mol
Monoisotopic Mass:
192.115g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
195
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:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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