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CAS 1205-72-7 4-AMINO-1-BENZYLPIPERIDINE DIHYDROCHLORIDE HYDRATE molecular structure lightbox
CAS RN: 1205-72-7

4-AMINO-1-BENZYLPIPERIDINE DIHYDROCHLORIDE HYDRATE

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260114 1g In stock Shanghai, Shenzhen, Wuhan Inquiry
Batchno.20251201 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20251113 5g In stock Wuhan Inquiry
  • Product code: SSC-021536
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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: 5g, 25g, 100g
  • 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 1205-72-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry
25g ≥95% 0 Out of Stock Hong Kong Inquiry
100g ≥95% 0 Out of Stock Beijing Inquiry

1205-72-7 / 1-benzylpiperidin-4-amine;dihydrochloride

1-Benzylpiperidin-4-amine dihydrochloride | 1-Benzyl-4-aminopiperidine dihydrochloride | 4-Amino-1-benzylpiperidine Dihydrochloride

Standard CAS: 1205-72-7 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1205-72-7
Multi CAS
Yes
Molecular Formula
C12H20Cl2N2
Molecular Weight
263.200000
Exact Mass
262.100354
SMILES
C1CN(CCC1N)CC2=CC=CC=C2.Cl.Cl
InChI
InChI=1S/C12H18N2.2ClH/c13-12-6-8-14(9-7-12)10-11-4-2-1-3-5-11;;/h1-5,12H,6-10,13H2;2*1H
InChIKey
RDEUNWFXSVDHCI-UHFFFAOYSA-N
Synonyms
1-Benzylpiperidin-4-amine dihydrochloride 1-Benzyl-4-aminopiperidine dihydrochloride 4-Amino-1-benzylpiperidine Dihydrochloride MFCD00044825 1-benzylpiperidin-4-amine;dihydrochloride

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
73.42
TPSA
29.26

LogP / Solubility

WLOGP
2.45
MLOGP
2.17
XLogP3
2.45
Consensus LogP
2.36
Log S (ESOL)
-3.16
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.49
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.65
Class (SILICOS-IT)
Poorly 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)
-2.58

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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