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Monoterpenoids

2-Carene, (+)-

PHY-NP-04273 · Natural product research catalog

Catalog numberPHY-NP-04273
CAS number4497-92-1
Molecular formulaC10H16
Molecular weight136.238 g/mol
Chemical classMonoterpenoids
Main reported sourceAspergillus candidus
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of 2-Carene, (+)-

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100 mgRequest quoteTo be confirmedConfirm in quotation

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Product information

2-Carene, (+)- is listed in the Monoterpenoids 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 name(1S,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-2-ene
SMILESCC1=C[C@H]2[C@H](C2(C)C)CC1
InChIKeyIBVJWOMJGCHRRW-BDAKNGLRSA-N
Subclass / scaffoldCarane monoterpenoids
PubChem CID78249

Computed properties

Exact mass (Da)136.1252Predicted LogP2.9987
Predicted TPSA (Ų)0.0H-bond donors0
H-bond acceptors0Rotatable bonds0

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

View additional properties & classification
Ring count2
Aromatic rings0
Fraction Csp³0.8
Synthetic accessibility score3.66
QED score0.449
Lipinski rule violations0
NPClassifier pathwayTerpenoids
NPClassifier superclassMonoterpenoids
NPClassifier classCarane monoterpenoids
Parent SMILESCC1=C[C@H]2[C@@H](CC1)C2(C)C
Parent formulaC10H16
Parent molecular weight136.238
Specified stereocenters2
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceAspergillus candidus
Reported source familiesAspergillaceae; Pinaceae; Solanaceae

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

View occurrence records & references
LOTUS / Wikidata speciesAspergillus candidus[1]; Picea abies[1]; tomato[1]
All reported source familiesAspergillaceae[1]; Pinaceae[1]; Solanaceae[1]
LOTUS species records3
LOTUS reference records3
COCONUT occurrence recordsAceriphyllum rossii; Agnorhiza bolanderi; Alligator mississippiensis; Amomum compactum; Amomum krervanh; Anaxagorea clavata; Angelica acutiloba; Angelica gigas; Angelica sinensis; Araujia sericifera; Aria pallescens; Arnica nevadensis; Artemisia annua L.; Artemisia apiacea; Artemisia monogyna; Aspergillus candidus; Bassia butyracea; Beyeria brevifolia; Bursaria spinosa; Chloranthus tianmushanensis; Chromolaena odorata; Chromolaena pulchella; Chrysanthemum indicum; Chrysanthemum x morifolium; Cinamomum cassia; Cinnamomum aromaticum; Citrus reticulata; Cladonia evansii; Clonostachys rosea; Cnidium officinale
COCONUT organism records74
COCONUT identifierCNP0263147.3

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.