1,3-Cyclopentanediol


Chemical Name: 1,3-Cyclopentanediol
CAS Number: 59719-74-3
Product Number: AG003DIG(AGN-PC-0JLC1T)
Synonyms:
MDL No:
Molecular Formula: C5H10O2
Molecular Weight: 102.1317

Identification/Properties


Properties
MP:
40 °C(lit.)
BP:
80-85 °C0.1 mm Hg(lit.)
Storage:
2-8℃;
Form:
Solid
Refractive Index:
n20/D 1.484(lit.)
Computed Properties
Molecular Weight:
102.133g/mol
XLogP3:
-0.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
102.068g/mol
Monoisotopic Mass:
102.068g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
55.1
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
3
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:
H225
Precautionary Statements:
P210-P273-P243-P403
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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