Benzenepropanol, a,a-dimethyl-


Chemical Name: Benzenepropanol, a,a-dimethyl-
CAS Number: 103-05-9
Product Number: AG003HNC(AGN-PC-0OS3AZ)
Synonyms:
MDL No:
Molecular Formula: C11H16O
Molecular Weight: 164.2441

Identification/Properties


Properties
MP:
31-33 °C(lit.)
BP:
144 °C85 mm Hg(lit.)
Storage:
Room Temperature;Keep in dry area;
Form:
Liquid
Refractive Index:
n20/D 1.509(lit.)
Computed Properties
Molecular Weight:
164.248g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
3
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:
123
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#:
1760
Hazard Statements:
H318
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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