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Aliphatics

UNDECANE

十一烷

PHY-NP-12817 · Natural product research catalog

Catalog numberPHY-NP-12817
CAS number1120-21-4
Molecular formulaC11H24
Molecular weight156.313 g/mol
Chemical classAliphatics
Main reported sourceAristolochia cymbifera
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of UNDECANE

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Product information

UNDECANE is listed in the Aliphatics section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC nameundecane
SMILESCCCCCCCCCCC
InChIKeyRSJKGSCJYJTIGS-UHFFFAOYSA-N
Subclass / scaffoldFatty acyls:Hydrocarbons
PubChem CID14257

Computed properties

Exact mass (Da)156.1878Predicted LogP4.5371
Predicted TPSA (Ų)0.0H-bond donors0
H-bond acceptors0Rotatable bonds8

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification
Ring count0
Aromatic rings0
Fraction Csp³1.0
Synthetic accessibility score1.19
QED score0.453
Lipinski rule violations0
NPClassifier pathwayFatty acids
NPClassifier superclassFatty acyls
NPClassifier classHydrocarbons
Parent SMILESCCCCCCCCCCC
Parent formulaC11H24
Parent molecular weight156.313
Specified stereocenters0
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceAristolochia cymbifera
Reported source familiesAsteraceae; Aristolochiaceae; Lamiaceae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references
LOTUS / Wikidata speciesAristolochia cymbifera[2]; Aristolochia gigantea[2]; Aristolochia macroura[2]; Aristolochia triangularis[2]; Asarum megacalyx[2]; Cistus creticus[2]; Mangifera indica[2]; Oecophylla smaragdina[2]; Pinus monticola[2]; garden chervil[2]; Allium ampeloprasum[1]; Araucaria cunninghamii[1]; Aristolochia didyma[1]; Aster scaber[1]; Bellis perennis[1]
All reported source familiesAsteraceae[11]; Aristolochiaceae[7]; Lamiaceae[6]; Pinaceae[5]; Cistaceae[4]; Apiaceae[3]
Genus / family recordsHeterotropa[1]; Streptomyces[1]
LOTUS species records68
LOTUS reference records63
COCONUT occurrence recordsAcronychia haplophylla; Alligator sinensis; Allium ampeloprasum; Amauris niavius; Ammodendron karelinii; Anacyclus pyrethrum; Angelica acutiloba; Angelica gigas; Angelica sinensis; Araucaria cunninghamii; Aristolochia cymbifera; Aristolochia didyma; Aristolochia gigantea; Aristolochia macroura; Aristolochia triangularis; Asarum megacalyx; Ascotricha chartarum; Aster scaber; Aster tataricus; Astilbe chinensis; Atractylodes lancea; Atractylodes macrocephala; Brachylaena perrieri; Brassica hirta; Brassica napus; Buglossoides arvensis; Camellia sinensis; Cannabis sativa; Caryocar coriaceum; Centaurea benedicta
COCONUT organism records163
COCONUT identifierCNP0270748.0

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

Request applicable documentation and handling information before ordering or use.