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CAS 4271-86-7 Methyl 12-Aminododecanoate, Hydrochloride molecular structure lightbox
CAS RN: 4271-86-7

Methyl 12-Aminododecanoate, Hydrochloride

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260617 100g In stock Shanghai Inquiry
Batchno.20260426 1g In stock Shanghai, Wuhan, Chengdu Inquiry
Batchno.20260421 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250404 25g In stock Shanghai Inquiry
Batchno.20250215 5g In stock Shanghai, Wuhan, Chengdu Inquiry
  • Product code: SSC-150989
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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 4271-86-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

4271-86-7 / methyl 12-aminododecanoate;hydrochloride

Standard CAS: 4271-86-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
4271-86-7
Multi CAS
No
Molecular Formula
C13H28CLNO2
Molecular Weight
265.820000
Exact Mass
265.180857
InChI
InChI=1S/C13H27NO2.ClH/c1-16-13(15)11-9-7-5-3-2-4-6-8-10-12-14;/h2-12,14H2,1H3;1H
InChIKey
UZAPWACCYWKXEL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.92
Rotatable bonds
11
H-bond acceptors
3
H-bond donors
1
Molar refractivity
74.49
TPSA
52.32

LogP / Solubility

WLOGP
3.44
MLOGP
3.04
XLogP3
3.44
Consensus LogP
3.31
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.22
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.56
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.9

Drug-likeness / Medicinal Chemistry

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

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