(+-)-Cannabichromene
Basic information
- CAS
18793-28-7- Standard SMILES
CCCCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2- InChIKey
UVOLYTDXHDXWJU-UHFFFAOYSA-N- Molecular formula
- C21H30O2
- Average molar mass
- 314.5 g/mol
- Monoisotopic mass
- 314.2245802
Overview
Cannabichromene is a 1-benzopyran.
Names & identifiers
- Preferred name
- (+-)-Cannabichromene
- IUPAC
- 2-methyl-2-(4-methylpent-3-enyl)-7-pentylchromen-5-ol
- English name
- cannabichromene
- Molecular formula
- C21H30O2
- Molecular weight
- 314.46
Names & synonyms
CANNABICHROMENE20675-51-8CannabichromeCannanbichromenePentylcannabichromeneCannabinochromeneK4497H250W2-Methyl-2-(4-methyl-3-pentenyl)-7-pentyl-2H-1-benzopyran-5-ol2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-chromen-5-olDTXSID80942873NSC-29183118793-28-7
Show more names
CannabichromoneCannabichromene (CBC)(±)-CannabichromeneCannabichromene solution(±)-Cannabichromene (CRM)
(+-)-CannabichromeneRefChem:573726DTXCID801371258(+/-)-Cannabichromene2-methyl-2-(4-methylpent-3-enyl)-7-pentylchromen-5-ol2-Methyl-2-(4-methylpent-3-en-1-yl)-7-pentyl-2H-chromen-5-ol2-Methyl-2-(4-methyl-3-penten-1-yl)-7-pentyl-2H-chromen-5-olCHEMBL422704
Database identifiers
- CAS
18793-28-7、20675-51-8- PubChem CID
- 30219
- DTXSID
DTXSID80942873- ChEMBL
CHEMBL422704- ChEBI
CHEBI:3357- UNII
- K4497H250W
- EC Number
- 809-024-3
- Nikkaji
- J10.941J
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 422
Experimental & physicochemical properties
Chemical ClassesStimulant
DrugsDEA NFLIS-Drug Category -> Cannabinoids
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 145 °C · 145°C
- Boiling point
- 394.13 °C · 394.13°C (rough estimate)
- Density
- 1.0536 · 1.0536 (rough estimate)
- refractive index
- 1.5404 · 1.5404 (estimate)
- Flash point
- 9 ℃ · 9℃
- storage temp.
- -20 °C · -20°C
- solubility
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- form
- Oil
- pka
- 9.68 · 9.68±0.40(Predicted)
- color
- Crystals
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 1
- ridadr
- UN1230 - class 3 - PG 2 - Methanol, solution
- hs_code
- 9999999999
- Toxicity
- dni-hmn:lyms 100 mmol/L FEPRA7 36,1748,77
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS06,GHS08
- Storage Class
- 3 - Flammable liquids
- target organs
- Eyes,Central nervous system
- Hazard statements
- H225-H301+H311+H331-H370
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 OralFlam. Liq. 2STOT SE 1
- Precautionary statements
- P210-P260-P280-P301+P310-P311
Chemistry & industry
Applications
DescriptionCannabichromene (CBC) is one of the most abundant cannabinoids found in the cannabis plant, next to CBD, THC, and CBG. It is particularly abundant in freshly harvested dry-type Cannabis material, and it is the second most abundant cannabinoid in some strains of marijuana growing in the USA. Like CBD, CBG does a poor job of binding to the endocannabinoid system's CB1 and CB2 receptors and is a non-psychoactive compound. Instead, CBC has been observed to have unique interactions with TRPV1 and TRPA1 receptors (vanilloid 1 and ankyrin 1 receptors). It has modest antinociceptive and anti‐inflammatory effects and potentiates some effects of Δ9‐tetrahydrocannabinol in vivo[1–2].
General DescriptionCannabichromene (CBC) is a non-psychoactive cannabinoid of Cannabis that reportedly exerts anti-inflammatory, antimicrobial and analgesic activity. This Certified Snap-N-Spike solution standard is suitable for cannabichromene testing methods by GC/MS, HPLC or LC-MS/MS for Cannabis potency testing or impurity profiling, pharmaceutical research, and forensic analysis. Cerilliant solution Certified Reference Materials (CRMs) of cannabinoids are supplied in a convenient, quantitative, US DEA-exempt solution format and with TK#s for Canadian customers.
Additional notes
DefinitionChEBI: Cannabichromene is a 1-benzopyran.
Suppliers
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Related reactions
3 records
Compound notes
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