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CAS 1195-79-5 FENCHONE molecular structure lightbox
CAS RN: 1195-79-5

FENCHONE

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250923 100mg In stock Shanghai Inquiry
Batchno.20251023 1g In stock Shanghai Inquiry
Batchno.20260611 250mg In stock Shanghai Inquiry
Batchno.20250815 5g In stock Shanghai Inquiry
  • Product code: SSC-020042
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1195-79-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1195-79-5 / 1,3,3-trimethylbicyclo[2.2.1]heptan-2-one

Fenchone | 1,3,3-Trimethylbicyclo[2.2.1]heptan-2-one | dl-fenchone

Standard CAS: 1195-79-5 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1195-79-5
Multi CAS
Yes
Molecular Formula
C10H16O
Molecular Weight
152.230000
Exact Mass
152.120115
SMILES
CC1(C2CCC(C2)(C1=O)C)C
InChI
InChI=1S/C10H16O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7H,4-6H2,1-3H3
InChIKey
LHXDLQBQYFFVNW-UHFFFAOYSA-N
Synonyms
Fenchone 1,3,3-Trimethylbicyclo[2.2.1]heptan-2-one dl-fenchone 1,3,3-Trimethyl-2-norbornanone Fenchon

Physical Properties

Melting Point
5-6 °C
Boiling Point
192.00 to 194.00 °C. @ 760.00 mm Hg
Density
0.941-0.946
Physical Description
Colorless liquid with a camphor-like odor; mp = 5 deg C; Liquid Clear colorless to pale yellow liquid, Camphor herbal earthy woody aroma
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.9
H-bond acceptors
1
Molar refractivity
44.24
TPSA
17.07

LogP / Solubility

WLOGP
2.4
MLOGP
2.11
XLogP3
2.3
Consensus LogP
2.27
Log S (ESOL)
-2.3
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.54
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.64
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.94

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5

Safety & Transport

Pictogram(s)
Flammable
Signal
Warning
GHS Hazard Statements
H226 (14%): Flammable liquid and vapor [Warning Flammable liquids] H226 (13%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501

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