1-Dodecanol, 2-octyl-


Chemical Name: 1-Dodecanol, 2-octyl-
CAS Number: 5333-42-6
Product Number: AG00I9IU(AGN-PC-0JKFVB)
Synonyms:
MDL No:
Molecular Formula: C20H42O
Molecular Weight: 298.5469

Identification/Properties


Properties
MP:
1 °C(lit.)
BP:
357.7°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.453(lit.)
Computed Properties
Molecular Weight:
298.555g/mol
XLogP3:
9.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
17
Exact Mass:
298.324g/mol
Monoisotopic Mass:
298.324g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
179
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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