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1-Dodecene-1,2-13C2

CAT: 0804-HY-W017072SSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W017072SSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
1-Dodecene-1,2-13C2 is the 13C labeled 1-Dodecene[1].
CAS Number
198332-88-6
UNSPSC
12352211
Hazard Statement
H227-H302+H332-H315-H319-H335-H413
Target
Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/1-dodecene-1-2-13c2.html
Solubility
10 mM in DMSO
Smiles
[13CH2]=[13CH]CCCCCCCCCC
Molecular Formula
C10 13C2H24
Molecular Weight
170.30
Precautions
P210-P261-P264-P270-P271-P273-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P370+P378-P403-P403+P233-P405-P501
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53 (2) :211-216.
Shipping Conditions
Room temperature
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

(1,2-~13~C_2_)Dodec-1-ene
CAS Number198332-88-6
PubChem CID16213509
IUPAC Name(1,2-13C2)dodec-1-ene
Molecular FormulaC12H24
Molecular Weight170.30
XLogP6.8
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count9
Heavy Atom Count12
Formal Charge0
Complexity84
SMILES
CCCCCCCCCC[13CH]=[13CH2]
InChI
InChI=1S/C12H24/c1-3-5-7-9-11-12-10-8-6-4-2/h3H,1,4-12H2,2H3/i1+1,3+1
InChIKey
CRSBERNSMYQZNG-ZKDXJZICSA-N
Chemical Structure
2D Structure
2D structure of (1,2-~13~C_2_)Dodec-1-ene
CAS: 198332-88-6
CID: 16213509
Formula: C12H24
MW: 170.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight170.30
XLogP36.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count9
Exact Mass170.194510436
Monoisotopic Mass170.194510436
Topological Polar Surface Area0 Ų
Heavy Atom Count12
Formal Charge0
Complexity84
Isotope Atom Count2
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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