[email protected]
CAS 1126832-40-3 isoindolin-5-ol hydrochloride molecular structure lightbox
CAS RN: 1126832-40-3

isoindolin-5-ol hydrochloride

Product Availability

Choose a grade to view its available package options.

4 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260626 100mg In stock Shanghai, Shenzhen Inquiry
Batchno.20260211 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
Batchno.20260402 1g Out of stock Inquiry
Batchno.20250126 250mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-013035
GET A QUOTE
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: 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 1126832-40-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

1126832-40-3 / 2,3-dihydro-1H-isoindol-5-ol;hydrochloride

DTXSID90659208 | 2,3-Dihydro-1H-isoindol-5-ol--hydrogen chloride (1/1) | RefChem:244759

Standard CAS: 1126832-40-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1126832-40-3
Multi CAS
No
Molecular Formula
C8H10ClNO
Molecular Weight
171.620000
Exact Mass
171.045092
SMILES
C1C2=C(CN1)C=C(C=C2)O.Cl
InChI
InChI=1S/C8H9NO.ClH/c10-8-2-1-6-4-9-5-7(6)3-8;/h1-3,9-10H,4-5H2;1H
InChIKey
GYWKBIQJSDFUSK-UHFFFAOYSA-N
Synonyms
DTXSID90659208 2,3-Dihydro-1H-isoindol-5-ol--hydrogen chloride (1/1) RefChem:244759 DTXCID60609957 Isoindolin-5-ol hydrochloride

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.25
H-bond acceptors
2
H-bond donors
2
Molar refractivity
45.9
TPSA
32.26

LogP / Solubility

WLOGP
1.42
MLOGP
1.24
XLogP3
1.42
Consensus LogP
1.36
Log S (ESOL)
-2.2
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.99
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.95
Class (SILICOS-IT)
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)
-2.76

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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

Customers Also Viewed

Get In Touch

Contact Us