Tetradecanedioic acid

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Product Information

Molecular Formula:
C14H26O4
Molecular Weight:
258.35
Description
Tetradecanedioic acid (CAS# 821-38-5) is a useful research chemical.
Synonyms
tetradecanedioic acid
IUPAC Name
tetradecanedioic acid
Canonical SMILES
C(CCCCCCC(=O)O)CCCCCC(=O)O
InChI
InChI=1S/C14H26O4/c15-13(16)11-9-7-5-3-1-2-4-6-8-10-12-14(17)18/h1-12H2,(H,15,16)(H,17,18)
InChI Key
HQHCYKULIHKCEB-UHFFFAOYSA-N
Boiling Point
427.81 °C (rough estimate)
Melting Point
124-127 °C (lit.)
Purity
98 %
Density
1.038 g/cm3
Solubility
0.2 mg/mL
Appearance
White fine powder
Refractive Index
1.4650 (estimate)
LogP
3.83680

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Danger

Computed Properties

XLogP3
4.3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
13
Exact Mass
258.18310931 g/mol
Monoisotopic Mass
258.18310931 g/mol
Topological Polar Surface Area
74.6Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
202
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
The molarity calculator equation

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

Calculate
The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

Calculate

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