CAS 138007-24-6 tert-Butyl piperidine-4-carboxylate molecular structure

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CAS RN: 138007-24-6

tert-Butyl piperidine-4-carboxylate

Product code: SSC-047965

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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, 100g, 25g, 500g, 1000g
Available purity: >98%
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 138007-24-6
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	>98%	5 In Stock	Beijing	Inquiry
5g	>98%	5 In Stock	Hong Kong	Inquiry
10g	>98%	5 In Stock	Shenzhen	Inquiry
100g	>98%	4 In Stock	Shanghai	Inquiry
25g	>98%	2 In Stock	Beijing	Inquiry
500g	>98%	0 Out of Stock	Beijing	Inquiry
1000g	>98%	0 Out of Stock	Hong Kong	Inquiry

138007-24-6 / tert-butyl piperidine-4-carboxylate

Standard CAS: 138007-24-6 Multi CAS: No

Basic Information Computed Properties Safety & Transport

Basic Information

CAS

138007-24-6

Multi CAS

Molecular Formula

C10H19NO2

Molecular Weight

185.260000

Exact Mass

185.141579

SMILES

CC(C)(C)OC(=O)C1CCNCC1

InChI

InChI=1S/C10H19NO2/c1-10(2,3)13-9(12)8-4-6-11-7-5-8/h8,11H,4-7H2,1-3H3

InChIKey

FUYBPBOHNIHCHM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Fraction Csp3

0.9

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

51.44

TPSA

38.33

LogP / Solubility

WLOGP

1.33

MLOGP

1.17

XLogP3

1.1

Consensus LogP

1.2

Log S (ESOL)

-1.76

Class (ESOL)

Soluble

Log S (Ali)

-2.04

Class (Ali)

Moderately soluble

Log S (SILICOS-IT)

-2.09

Class (SILICOS-IT)

Moderately soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

CYP2D6 inhibitor

CYP3A4 inhibitor

Log Kp (skin permeation)

-2.91

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Bioavailability score

0.55

Leadlikeness

Synthetic Accessibility

1.5

Safety & Transport

Pictogram(s)

Irritant

Signal

Warning

GHS Hazard Statements

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statement Codes

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501