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CAS 1033718-20-5 tert-Butyl N-(trans-3-hydroxycyclobutyl)-N-MethylcarbaMate molecular structure lightbox
CAS RN: 1033718-20-5

tert-Butyl N-(trans-3-hydroxycyclobutyl)-N-MethylcarbaMate

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251020 100mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-004861
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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: ≥95%
  • 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 1033718-20-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

1033718-20-5 / tert-butyl N-(3-hydroxycyclobutyl)-N-methylcarbamate

Carbamic acid, N-(3-hydroxycyclobutyl)-N-methyl-, 1,1-dimethylethyl ester | RefChem:332656 | TERT-BUTYL N-(TRANS-3-HYDROXYCYCLOBUTYL)-N-METHYLCARBAMATE

Standard CAS: 1033718-20-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1033718-20-5
Multi CAS
Yes
Molecular Formula
C10H19NO3
Molecular Weight
201.260000
Exact Mass
201.136493
SMILES
CC(C)(C)OC(=O)N(C)C1CC(C1)O
InChI
InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11(4)7-5-8(12)6-7/h7-8,12H,5-6H2,1-4H3
InChIKey
AWAUKBRXWGIKJB-UHFFFAOYSA-N
Synonyms
Carbamic acid, N-(3-hydroxycyclobutyl)-N-methyl-, 1,1-dimethylethyl ester RefChem:332656 TERT-BUTYL N-(TRANS-3-HYDROXYCYCLOBUTYL)-N-METHYLCARBAMATE tert-Butyl N-(3-hydroxycyclobutyl)-N-methylcarbamate tert-Butyl N-(cis-3-hydroxycyclobutyl)-N-methylcarbamate

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
0.9
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
53.03
TPSA
49.77

LogP / Solubility

WLOGP
1.38
MLOGP
1.21
XLogP3
1
Consensus LogP
1.2
Log S (ESOL)
-1.89
Class (ESOL)
Soluble
Log S (Ali)
-2.2
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.23
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)
-2.97

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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