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CAS 1001907-64-7 5,8-Dioxa-spiro[3.4]octane-2-carboxylic acid molecular structure lightbox
CAS RN: 1001907-64-7

5,8-Dioxa-spiro[3.4]octane-2-carboxylic acid

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260405 1g In stock Shanghai, Tianjin Inquiry
Batchno.20260415 250mg In stock Shanghai Inquiry
Batchno.20250626 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
Batchno.20250923 25g In stock Shanghai Inquiry
Batchno.20250331 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: SSC-000607
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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: 5g
  • Available purity: ＞97%
  • 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 1001907-64-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

1001907-64-7 / 5,8-dioxaspiro[3.4]octane-2-carboxylic acid

5,8-dioxaspiro[3.4]octane-2-carboxylic acid | DTXSID90669726 | 5,8-Dioxaspiro(3.4)octane-2-carboxylic acid

Standard CAS: 1001907-64-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1001907-64-7
Multi CAS
No
Molecular Formula
C7H10O4
Molecular Weight
158.150000
Exact Mass
158.057909
SMILES
C1COC2(O1)CC(C2)C(=O)O
InChI
InChI=1S/C7H10O4/c8-6(9)5-3-7(4-5)10-1-2-11-7/h5H,1-4H2,(H,8,9)
InChIKey
PGWGOPXPTJDZKT-UHFFFAOYSA-N
Synonyms
5,8-dioxaspiro[3.4]octane-2-carboxylic acid DTXSID90669726 5,8-Dioxaspiro(3.4)octane-2-carboxylic acid RefChem:298971 DTXCID10620475

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.86
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
34.99
TPSA
55.76

LogP / Solubility

WLOGP
0.22
MLOGP
0.19
XLogP3
-0.3
Consensus LogP
0.04
Log S (ESOL)
-0.9
Class (ESOL)
Very soluble
Log S (Ali)
-1.02
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.99
Class (SILICOS-IT)
Very 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)
-3.53

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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