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CAS 54322-10-0 L-GLUTAMIC BENZYL ESTER molecular structure lightbox
CAS RN: 54322-10-0

L-GLUTAMIC BENZYL ESTER

  • Product code: SSC-161955
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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, 100g, 1g, 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 3
  • 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 54322-10-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ＞97% 2 In Stock Beijing Inquiry
25g ＞97% 2 In Stock Beijing Inquiry
100g ＞97% 2 In Stock Shenzhen Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

54322-10-0 / 5-oxo-5-phenylmethoxypentanoic acid

Standard CAS: 54322-10-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
54322-10-0
Multi CAS
Yes
Molecular Formula
C12H14O4
Molecular Weight
222.240000
Exact Mass
222.089209
InChI
InChI=1S/C12H14O4/c13-11(14)7-4-8-12(15)16-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,13,14)
InChIKey
WRSDJJXJDSEUSQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
1
Molar refractivity
57.72
TPSA
63.6

LogP / Solubility

WLOGP
1.98
MLOGP
1.75
XLogP3
1.8
Consensus LogP
1.84
Log S (ESOL)
-2.35
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.82
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.47
Class (SILICOS-IT)
Poorly 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)
-2.67

Drug-likeness / Medicinal Chemistry

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

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