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CAS 122332-24-5 methyl (R)-2-amino-3-(4-bromophenyl)propanoate molecular structure lightbox
CAS RN: 122332-24-5

methyl (R)-2-amino-3-(4-bromophenyl)propanoate

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250302 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-025282
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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: 0.1g, 1g, 10g, 0.25g, 5g
  • Available purity: >98%
  • Inventory rows with stock: 5
  • 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 122332-24-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >98% 5 In Stock Beijing Inquiry
1g >98% 5 In Stock Shenzhen Inquiry
10g >98% 5 In Stock Beijing Inquiry
0.25g >98% 1 In Stock Shanghai Inquiry
5g >98% 1 In Stock Shanghai Inquiry

122332-24-5 / methyl (2R)-2-amino-3-(4-bromophenyl)propanoate

Standard CAS: 122332-24-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
122332-24-5
Multi CAS
No
Molecular Formula
C10H12BrNO2
Molecular Weight
258.110000
Exact Mass
257.005140
SMILES
COC(=O)[C@@H](CC1=CC=C(C=C1)Br)N
InChI
InChI=1S/C10H12BrNO2/c1-14-10(13)9(12)6-7-2-4-8(11)5-3-7/h2-5,9H,6,12H2,1H3/t9-/m1/s1
InChIKey
YQWYXOBDKUWXCE-SECBINFHSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
57.84
TPSA
52.32

LogP / Solubility

WLOGP
1.49
MLOGP
1.32
XLogP3
1.9
Consensus LogP
1.57
Log S (ESOL)
-2.5
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.75
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.94
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.24

Drug-likeness / Medicinal Chemistry

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

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