Octane, chloro-


Chemical Name: Octane, chloro-
CAS Number: 111-85-3
Product Number: AG003E8Q(AGN-PC-0JK8E9)
Synonyms:
MDL No:
Molecular Formula: C8H17Cl
Molecular Weight: 148.6736

Identification/Properties


Properties
MP:
−61 °C(lit.)
BP:
181.5°C
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
n20/D 1.430(lit.)
Solubility:
0.02g/l
Computed Properties
Molecular Weight:
148.674g/mol
XLogP3:
4.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
6
Exact Mass:
148.102g/mol
Monoisotopic Mass:
148.102g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
43.8
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:
Danger
UN#:
3082
Hazard Statements:
H227-H304-H410
Precautionary Statements:
P210-P273-P280-P301+P310-P331-P337+P313-P370+P378-P391-P403+P235-P405-P501
Class:
9
Packing Group:

NMR Spectrum


Other Analytical Data


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