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CAS 119565-00-3 L-3-CHLOROPHENYLGLYCINE molecular structure lightbox
CAS RN: 119565-00-3

L-3-CHLOROPHENYLGLYCINE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260117 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-020093
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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: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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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 119565-00-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

119565-00-3 / (2S)-2-amino-2-(3-chlorophenyl)acetic acid

2-amino-2-(3-chlorophenyl)acetic acid | RefChem:463396 | 676-155-9

Standard CAS: 119565-00-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
119565-00-3
Multi CAS
Yes
Molecular Formula
C8H8ClNO2
Molecular Weight
185.610000
Exact Mass
185.024356
SMILES
C1=CC(=CC(=C1)Cl)[C@@H](C(=O)O)N
InChI
InChI=1S/C8H8ClNO2/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7H,10H2,(H,11,12)/t7-/m0/s1
InChIKey
MGOUENCSVMAGSE-ZETCQYMHSA-N
Synonyms
2-amino-2-(3-chlorophenyl)acetic acid RefChem:463396 676-155-9 Amino-(3-chloro-phenyl)-acetic acid DL-(3-Chlorophenyl)glycine

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
46.02
TPSA
63.32

LogP / Solubility

WLOGP
1.42
MLOGP
1.25
XLogP3
-1.1
Consensus LogP
0.52
Log S (ESOL)
-2.13
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.11
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.29
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)
-2.84

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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