4-Heptanol, 2,6-dimethyl-


Chemical Name: 4-Heptanol, 2,6-dimethyl-
CAS Number: 108-82-7
Product Number: AG003PJI(AGN-PC-0JK8BK)
Synonyms:
MDL No:
Molecular Formula: C9H20O
Molecular Weight: 144.2545

Identification/Properties


Properties
MP:
-65.15°C
BP:
177.2-180°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.423(lit.)
Computed Properties
Molecular Weight:
144.258g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
4
Exact Mass:
144.151g/mol
Monoisotopic Mass:
144.151g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
66.8
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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