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Methyl 10-methylundecanoate

CAT: 0931-TYD-01028-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-TYD-01028-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5129-56-6
Bioactivity
Methyl 10-methylundecanoate is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
Smiles
CC(C)CCCCCCCCC(OC)=O
Molecular Formula
C13H26O2
Molecular Weight
214.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Methyl 10-methylundecanoate
CAS Number5129-56-6
PubChem CID554144
IUPAC Namemethyl 10-methylundecanoate
Molecular FormulaC13H26O2
Molecular Weight214.34
XLogP5.5
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count10
Heavy Atom Count15
Formal Charge0
Complexity153
SMILES
CC(C)CCCCCCCCC(=O)OC
InChI
InChI=1S/C13H26O2/c1-12(2)10-8-6-4-5-7-9-11-13(14)15-3/h12H,4-11H2,1-3H3
InChIKey
XPVCTJYIICVJOE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 10-methylundecanoate
CAS: 5129-56-6
CID: 554144
Formula: C13H26O2
MW: 214.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight214.34
XLogP35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count10
Exact Mass214.193280068
Monoisotopic Mass214.193280068
Topological Polar Surface Area26.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity153
Isotope Atom Count0
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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Alternative Products

CatalogName
sc-215314Methyl 10-methylundecanoate
HY-165933Methyl 9-methylundecanoate
MBS577470310-Methyl-10-deazaaminopterin
OR1052012-0110-Methyl-9,10-dihydroacridine
OR1066815-01Methyl 10-chloro-10-oxodecanoate
454695-01Methyl 10-​Undecenoate (10-Undecenoic Acid Methyl Ester)
TRC-U788830-25GMethyl 10-Undecenoate(10-Undecenoic Acid Methyl Ester)
HY-W404252Methyl 10-hydroxydecanoate
AAA87010-01Methyl 10-oxooctadecanoate
FM71124Methyl 10-undecenoate

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