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CAS 5678-45-5 3-Amino-3-(4-methoxyphenyl)propionic Acid molecular structure lightbox
CAS RN: 5678-45-5

3-Amino-3-(4-methoxyphenyl)propionic Acid

Product Availability

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8 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250920 1g In stock Inquiry
Batchno.20251130 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250930 10g In stock Shanghai Inquiry
Batchno.20250118 1g In stock Shanghai Inquiry
Batchno.20260324 1g / 5g Confirm by inquiry Shanghai Inquiry
Batchno.20260303 250mg In stock Shanghai, Wuhan, Chengdu Inquiry
Batchno.20250809 25g In stock Shanghai Inquiry
Batchno.20260603 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-164803
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 10g, 25g, 1g, 5g, 100g
  • Available purity: ≥97%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 5678-45-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 5 In Stock Beijing Inquiry
25g ≥97% 5 In Stock Beijing Inquiry
1g ≥97% 4 In Stock Shanghai Inquiry
5g ≥97% 3 In Stock Beijing Inquiry
100g ≥97% 0 Out of Stock Hong Kong Inquiry

5678-45-5 / 3-amino-3-(4-methoxyphenyl)propanoic acid

Standard CAS: 5678-45-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5678-45-5
Multi CAS
Yes
Molecular Formula
C10H13NO3
Molecular Weight
195.210000
Exact Mass
195.089543
InChI
InChI=1S/C10H13NO3/c1-14-8-4-2-7(3-5-8)9(11)6-10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)
InChIKey
NYTANCDDCQVQHG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
2
Molar refractivity
52.18
TPSA
72.55

LogP / Solubility

WLOGP
1.17
MLOGP
1.03
XLogP3
-1.4
Consensus LogP
0.27
Log S (ESOL)
-1.84
Class (ESOL)
Soluble
Log S (Ali)
-2.01
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.38
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)
-3.08

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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