1,3-Cyclopentanediol, mixture of cis and trans

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Product Information

Molecular Formula
C5H10O2
Molecular Weight
102.13
Description
1,3-Cyclopentanediol, mixture of cis and trans (CAS# 59719-74-3) is a useful research chemical.
Synonyms
cyclopentane-1,3-diol
IUPAC Name
cyclopentane-1,3-diol
SMILES
C1CC(CC1O)O
InChI
InChI=1S/C5H10O2/c6-4-1-2-5(7)3-4/h4-7H,1-3H2
InChI Key
NUUPJBRGQCEZSI-UHFFFAOYSA-N
Boiling Point
80-85 °C0.1 mmHg (lit.)
Melting Point
40 °C (lit.)
Flash Point
235.4 °CF
Purity
95 %
Density
1.094 g/cm3
Appearance
Clear colorless to slightly yellow liquid
Storage
0-6 °C
Refractive Index
n20/D 1.484 (lit.)
LogP
-0.10790

Computed Properties

XLogP3
-0.2
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
0
Exact Mass
102.068079557 g/mol
Monoisotopic Mass
102.068079557 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
7
Formal Charge
0
Complexity
55.1
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
2
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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