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Myristic Acid-d27

CAT: 0572-TRC-M884625-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M884625-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
60658-41-5
Synonyms
Tetradecanoic-d27 acid
Hazard Statement
No Data Available
Purity
>95% (GC)
Smiles
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)O
Molecular Formula
C14 D27 H O2
Molecular Weight
255.54
InChI
InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2
Additionnal Information
IUPAC name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosadeuteriotetradecanoic acid
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

(~2~H_27_)Tetradecanoic acid

Tetradecanoic-d27 acid is a C14 straight-chain saturated fatty acid where the aliphatic hydrogens have been replaced by deuterium atoms. It has a role as a fungal metabolite and a bacterial metabolite. It is a long-chain fatty acid, a straight-chain saturated fatty acid and a deuterated fatty acid. It is functionally related to a tetradecanoic acid.

CAS Number60658-41-5
PubChem CID16212357
IUPAC Name2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosadeuteriotetradecanoic acid
Molecular FormulaC14H28O2
Molecular Weight255.54
XLogP5.3
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count12
Heavy Atom Count16
Formal Charge0
Complexity155
SMILES
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)O
InChI
InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2
InChIKey
TUNFSRHWOTWDNC-RZVOLPTOSA-N
Chemical Structure
2D Structure
2D structure of (~2~H_27_)Tetradecanoic acid
CAS: 60658-41-5
CID: 16212357
Formula: C14H28O2
MW: 255.54
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight255.54
XLogP35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count12
Exact Mass255.378402272
Monoisotopic Mass255.378402272
Topological Polar Surface Area37.3 Ų
Heavy Atom Count16
Formal Charge0
Complexity155
Isotope Atom Count27
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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HY-N2041-01Myristic acid
HY-140335-01Alkynyl myristic acid
T84798-01Azido Myristic Acid
DE2091Myristic acid-D3
MBS393779-01Tetradecanoic-D27 Acid

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