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CAS 1212-53-9 N-Carbobenzoxyglycine Methyl Ester molecular structure lightbox
CAS RN: 1212-53-9

N-Carbobenzoxyglycine Methyl Ester

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260220 100g In stock Inquiry
Batchno.20251102 25g In stock Inquiry
Batchno.20250815 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250304 5g / 25g / 100g / 500g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: SSC-022941
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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: 5g, 10g, 25g, 100g, 500g, 1000g
  • Available purity: >97%
  • Inventory rows with stock: 6
  • 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 1212-53-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 5 In Stock Hong Kong Inquiry
10g >97% 5 In Stock Beijing Inquiry
25g >97% 5 In Stock Shenzhen Inquiry
100g >97% 5 In Stock Hong Kong Inquiry
500g >97% 2 In Stock Shenzhen Inquiry
1000g >97% 1 In Stock Shanghai Inquiry

1212-53-9 / methyl 2-(phenylmethoxycarbonylamino)acetate

Methyl N-benzyloxycarbonylglycinate | Methyl 2-(((benzyloxy)carbonyl)amino)acetate | Carbobenzyloxyglycine methyl ester

Standard CAS: 1212-53-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1212-53-9
Multi CAS
Yes
Molecular Formula
C11H13NO4
Molecular Weight
223.220000
Exact Mass
223.084458
SMILES
COC(=O)CNC(=O)OCC1=CC=CC=C1
InChI
InChI=1S/C11H13NO4/c1-15-10(13)7-12-11(14)16-8-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,12,14)
InChIKey
DZYBBBYFLOPVOL-UHFFFAOYSA-N
Synonyms
Methyl N-benzyloxycarbonylglycinate Methyl 2-(((benzyloxy)carbonyl)amino)acetate Carbobenzyloxyglycine methyl ester Carbobenzoxyglycine methyl ester Glycine, N-[(phenylmethoxy)carbonyl]-, methyl ester

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.27
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
56.65
TPSA
64.63

LogP / Solubility

WLOGP
1.09
MLOGP
0.96
XLogP3
1.4
Consensus LogP
1.15
Log S (ESOL)
-1.92
Class (ESOL)
Soluble
Log S (Ali)
-2.17
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.49
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)
-3.31

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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