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CAS 480-33-1 (3R)-8-hydroxy-3-methyl-isochroman-1-one molecular structure lightbox
CAS RN: 480-33-1

(3R)-8-hydroxy-3-methyl-isochroman-1-one

Product Availability

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityInquiry
Batchno.20250104 1mg In stock Inquiry
Batchno.20260524 25mg In stock Inquiry
Batchno.20250523 5mg In stock Inquiry
Batch No.PackageAvailabilityInquiry
Batchno.20250517 5mg Out of stock Inquiry
  • Product code: SSC-154967
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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 480-33-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

480-33-1 / 8-hydroxy-3-methyl-3,4-dihydroisochromen-1-one

Standard CAS: 480-33-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
480-33-1
Multi CAS
Yes
Molecular Formula
C10H10O3
Molecular Weight
178.180000
Exact Mass
178.062994
InChI
InChI=1S/C10H10O3/c1-6-5-7-3-2-4-8(11)9(7)10(12)13-6/h2-4,6,11H,5H2,1H3
InChIKey
KWILGNNWGSNMPA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
46.69
TPSA
46.53

LogP / Solubility

WLOGP
1.49
MLOGP
1.31
XLogP3
2.4
Consensus LogP
1.73
Log S (ESOL)
-2.23
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.1
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.06
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)
-2.75

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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