[email protected]
CAS 106562-32-7 7-Amino-4-methylcoumarin-3-acetic Acid molecular structure lightbox
CAS RN: 106562-32-7

7-Amino-4-methylcoumarin-3-acetic Acid

Product Availability

Choose a grade to view its available package options.

8 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250210 100mg In stock Shanghai Inquiry
Batchno.20251106 1g In stock Shanghai Inquiry
Batchno.20251218 250mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250104 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250809 100mg In stock Inquiry
Batchno.20250406 250mg In stock Inquiry
Batchno.20250313 500mg In stock Inquiry
Batchno.20260304 50mg In stock Inquiry
  • Product code: SSC-008191
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: ＞97%
  • 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 106562-32-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ＞97% 0 Out of Stock Beijing Inquiry

106562-32-7 / 2-(7-amino-4-methyl-2-oxochromen-3-yl)acetic acid

7-Amino-4-methylcoumarin-3-acetic acid | 7-Amino-4-methyl-3-coumarinylacetic acid | DTXSID20147648

Standard CAS: 106562-32-7 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
106562-32-7
Multi CAS
Yes
Molecular Formula
C12H11NO4
Molecular Weight
233.220000
Exact Mass
233.068808
SMILES
CC1=C(C(=O)OC2=C1C=CC(=C2)N)CC(=O)O
InChI
InChI=1S/C12H11NO4/c1-6-8-3-2-7(13)4-10(8)17-12(16)9(6)5-11(14)15/h2-4H,5,13H2,1H3,(H,14,15)
InChIKey
QEQDLKUMPUDNPG-UHFFFAOYSA-N
Synonyms
7-Amino-4-methylcoumarin-3-acetic acid 7-Amino-4-methyl-3-coumarinylacetic acid DTXSID20147648 7-AMCA compound RefChem:105782

Physical Properties

Physical Description
Light brown powder
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
10
Fraction Csp3
0.17
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
62.97
TPSA
93.53

LogP / Solubility

WLOGP
1.31
MLOGP
1.16
XLogP3
0.6
Consensus LogP
1.02
Log S (ESOL)
-2.42
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.42
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.5
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.21

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
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, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us