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CAS 62396-48-9 N-(tert-Butoxycarbonyl)-D-aspartic Acid molecular structure lightbox
CAS RN: 62396-48-9

N-(tert-Butoxycarbonyl)-D-aspartic Acid

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260428 100g Out of stock 5-7 business days Inquiry
Batchno.20250913 1g In stock Shanghai Inquiry
Batchno.20260222 5g In stock Shandong Inquiry
  • Product code: SSC-171555
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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: 100g
  • 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 62396-48-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥97% 0 Out of Stock Shanghai Inquiry

62396-48-9 / (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioic acid

Standard CAS: 62396-48-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
62396-48-9
Multi CAS
Yes
Molecular Formula
C9H15NO6
Molecular Weight
233.220000
Exact Mass
233.089937
InChI
InChI=1S/C9H15NO6/c1-9(2,3)16-8(15)10-5(7(13)14)4-6(11)12/h5H,4H2,1-3H3,(H,10,15)(H,11,12)(H,13,14)/t5-/m0/s1
InChIKey
KAJBMCZQVSQJDE-YFKPBYRVSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.67
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
3
Molar refractivity
53.05
TPSA
112.93

LogP / Solubility

WLOGP
0.44
MLOGP
0.39
XLogP3
0.1
Consensus LogP
0.31
Log S (ESOL)
-1.3
Class (ESOL)
Soluble
Log S (Ali)
-1.79
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.02
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.83

Drug-likeness / Medicinal Chemistry

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

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