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93638-02-9 Purity
96%
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Dodecanoic-1-13c acid(9ci)
CAS
93639-08-8
Catalog Number
ACM93639088
Category
Other Products
Molecular Weight
201.33
Molecular Formula
C12H24O2
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Specification
Synonyms
Lauric acid-1-13C, Dodecanoic acid-1-13C, 292168_ALDRICH, FT-0695772, 93639-08-8
IUPAC Name
dodecanoic acid
Canonical SMILES
CCCCCCCCCCCC(=O)O
InChI Key
POULHZVOKOAJMA-HNHCFKFXSA-N
Boiling Point
225ºC100 mm Hg(lit.)
Melting Point
44-46ºC(lit.)
Flash Point
>230 °F
Density
0.905 g/cm³
Exact Mass
201.18100
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
2
H-Bond Donor
1
Safety Description
26-36/39
What is the molecular formula of Dodecanoic-1-13c acid(9ci)?
The molecular formula of Dodecanoic-1-13c acid(9ci) is C12H24O2.
What is the molecular weight of Dodecanoic-1-13c acid(9ci)?
The molecular weight of Dodecanoic-1-13c acid(9ci) is 201.31 g/mol.
When was Dodecanoic-1-13c acid(9ci) created in PubChem?
Dodecanoic-1-13c acid(9ci) was created on February 7, 2007.
What is the InChIKey of Dodecanoic-1-13c acid(9ci)?
The InChIKey of Dodecanoic-1-13c acid(9ci) is POULHZVOKOAJMA-HNHCFKFXSA-N.
How many hydrogen bond donor counts are there in Dodecanoic-1-13c acid(9ci)?
There is 1 hydrogen bond donor count in Dodecanoic-1-13c acid(9ci).
What is the topological polar surface area of Dodecanoic-1-13c acid(9ci)?
The topological polar surface area of Dodecanoic-1-13c acid(9ci) is 37.3 Ų.
Is Dodecanoic-1-13c acid(9ci) a canonicalized compound in PubChem?
Yes, Dodecanoic-1-13c acid(9ci) is a canonicalized compound in PubChem.
How many covalently-bonded unit counts are there in Dodecanoic-1-13c acid(9ci)?
There is 1 covalently-bonded unit count in Dodecanoic-1-13c acid(9ci).
What is the XLogP3 value of Dodecanoic-1-13c acid(9ci)?
The XLogP3 value of Dodecanoic-1-13c acid(9ci) is 4.2.
How many rotatable bond counts are there in Dodecanoic-1-13c acid(9ci)?
There are 10 rotatable bond counts in Dodecanoic-1-13c acid(9ci).
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