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CAS 114622-81-0 Nα-(tert-Butoxycarbonyl)-D-arginine Hydrochloride Monohydrate molecular structure lightbox
CAS RN: 114622-81-0

Nα-(tert-Butoxycarbonyl)-D-arginine Hydrochloride Monohydrate

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251218 100g / 500g Out of stock 8-10 business days Inquiry
  • Product code: SSC-014328
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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: 1g, 5g, 10g, 25g, 100g
  • Available purity: ≥97%
  • 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 114622-81-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 5 In Stock Shenzhen Inquiry
5g ≥97% 5 In Stock Hong Kong Inquiry
10g ≥97% 5 In Stock Shanghai Inquiry
25g ≥97% 5 In Stock Shanghai Inquiry
100g ≥97% 5 In Stock Shenzhen Inquiry

114622-81-0 / (2S)-5-(diaminomethylideneamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid;hydrate;hydrochloride

RefChem:569779 | Boc-L-Arginine.HCl.H2O | 692-148-3

Standard CAS: 114622-81-0 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
114622-81-0
Multi CAS
Yes
Molecular Formula
C11H25ClN4O5
Molecular Weight
328.790000
Exact Mass
328.151348
SMILES
CC(C)(C)OC(=O)N[C@@H](CCCN=C(N)N)C(=O)O.O.Cl
InChI
InChI=1S/C11H22N4O4.ClH.H2O/c1-11(2,3)19-10(18)15-7(8(16)17)5-4-6-14-9(12)13;;/h7H,4-6H2,1-3H3,(H,15,18)(H,16,17)(H4,12,13,14);1H;1H2/t7-;;/m0../s1
InChIKey
OVXLPYFDJUFEHQ-KLXURFKVSA-N
Synonyms
RefChem:569779 Boc-L-Arginine.HCl.H2O 692-148-3 N2-Boc-L-arginine Hydrochloride Hydrate Boc-L-Arg-OH.HCl.H2O

Computed Properties

Structural Parameters

Heavy atom count
21
Fraction Csp3
0.73
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
4
Molar refractivity
81.57
TPSA
171.53

LogP / Solubility

WLOGP
-0.38
MLOGP
-0.32
XLogP3
-0.38
Consensus LogP
-0.36
Log S (ESOL)
-1.24
Class (ESOL)
Soluble
Log S (Ali)
-1.98
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.2
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
Low
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)
-5

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 2 of 2 companies. For more detailed information, please visit ECHA C&L website.

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