6-Hepten-1-ol


Chemical Name: 6-Hepten-1-ol
CAS Number: 4117-10-6
Product Number: AG003N84(AGN-PC-0JSMFK)
Synonyms:
MDL No:
Molecular Formula: C7H14O
Molecular Weight: 114.1855

Identification/Properties


Properties
MP:
26°C (estimate)
BP:
153.1°C at 760 mmHg
Storage:
-10 ℃;
Form:
Liquid
Refractive Index:
1.4380 to 1.4420
Computed Properties
Molecular Weight:
114.188g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
5
Exact Mass:
114.104g/mol
Monoisotopic Mass:
114.104g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
50.3
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#:
1987
Hazard Statements:
H226
Precautionary Statements:
P210-P233-P240-P241+P242+P243-P280-P303+P361+P353-P370+P378-P403+P235-P501
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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