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CAS 1001907-44-3 1-Boc-azetidine-3-carboxy… molecular structure lightbox
CAS RN: 1001907-44-3

1-Boc-azetidine-3-carboxy…

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250715 100mg Out of stock 1 business days Inquiry
  • Product code: SSC-000601
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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: 0.1g, 0.25g, 1g, 5g, 10g
  • Available purity: >97%
  • Inventory rows with stock: 4
  • 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 1001907-44-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >97% 1 In Stock Shenzhen Inquiry
0.25g >97% 1 In Stock Beijing Inquiry
1g >97% 1 In Stock Shanghai Inquiry
5g >97% 1 In Stock Shenzhen Inquiry
10g >97% 0 Out of Stock Beijing Inquiry

1001907-44-3 / tert-butyl 3-(hydrazinecarbonyl)azetidine-1-carboxylate

tert-butyl 3-(hydrazinecarbonyl)azetidine-1-carboxylate | DTXSID20676468 | RefChem:383324

Standard CAS: 1001907-44-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1001907-44-3
Multi CAS
No
Molecular Formula
C9H17N3O3
Molecular Weight
215.250000
Exact Mass
215.126991
SMILES
CC(C)(C)OC(=O)N1CC(C1)C(=O)NN
InChI
InChI=1S/C9H17N3O3/c1-9(2,3)15-8(14)12-4-6(5-12)7(13)11-10/h6H,4-5,10H2,1-3H3,(H,11,13)
InChIKey
IOXCKRNGHYJOAQ-UHFFFAOYSA-N
Synonyms
tert-butyl 3-(hydrazinecarbonyl)azetidine-1-carboxylate DTXSID20676468 RefChem:383324 DTXCID60627217 869-375-3

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.78
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
53.63
TPSA
84.66

LogP / Solubility

WLOGP
-0.16
MLOGP
-0.14
XLogP3
-0.6
Consensus LogP
-0.3
Log S (ESOL)
-1.01
Class (ESOL)
Soluble
Log S (Ali)
-1.21
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.05
Class (SILICOS-IT)
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)
-4.14

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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