Hexanol


Chemical Name: Hexanol
CAS Number: 111-27-3
Product Number: AG003QX8(AGN-PC-00GQEQ)
Synonyms:
MDL No:
Molecular Formula: C6H14O
Molecular Weight: 102.1748

Identification/Properties


Properties
MP:
−52 °C(lit.)
BP:
157.6°C
Storage:
Room Temperature;Keep in dry area;
Form:
Solid
Refractive Index:
n20/D 1.418(lit.)
Solubility:
ethanol: soluble(lit.)
Computed Properties
Molecular Weight:
102.177g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
4
Exact Mass:
102.104g/mol
Monoisotopic Mass:
102.104g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
27.4
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#:
2282
Hazard Statements:
H226-H302+H312-H319-H412
Precautionary Statements:
P210-P233-P240-P241-P242-P243-P264-P270-P273-P280-P301+P312+P330-P303+P361+P353-P305+P351+P338-P337+P313-P363-P370+P378-P403+P235-P501
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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