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CAS 10429-82-0 N-Benzyl-N,N-bis(2-chloroethyl)amine Hydrochloride molecular structure lightbox
CAS RN: 10429-82-0

N-Benzyl-N,N-bis(2-chloroethyl)amine Hydrochloride

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250408 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-006043
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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, 25g, 100g, 500g, 1000g
  • Available purity: ≥95%
  • Inventory rows with stock: 3
  • 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 10429-82-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 5 In Stock Shanghai Inquiry
5g ≥95% 5 In Stock Beijing Inquiry
10g ≥95% 4 In Stock Hong Kong Inquiry
25g ≥95% 0 Out of Stock Hong Kong Inquiry
100g ≥95% 0 Out of Stock Shenzhen Inquiry
500g ≥95% 0 Out of Stock Shanghai Inquiry
1000g ≥95% 0 Out of Stock Beijing Inquiry

10429-82-0 / N-benzyl-2-chloro-N-(2-chloroethyl)ethanamine;hydrochloride

benzylbis(2-chloroethyl)amine hydrochloride | N,N-Bis(2-chloroethyl)benzylamine hydrochloride | N-benzylbis(2-chloroethyl)amine hydrochloride

Standard CAS: 10429-82-0 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
10429-82-0
Multi CAS
Yes
Molecular Formula
C11H16Cl3N
Molecular Weight
268.600000
Exact Mass
267.034833
SMILES
C1=CC=C(C=C1)CN(CCCl)CCCl.Cl
InChI
InChI=1S/C11H15Cl2N.ClH/c12-6-8-14(9-7-13)10-11-4-2-1-3-5-11;/h1-5H,6-10H2;1H
InChIKey
AZRWNJFEUSHORT-UHFFFAOYSA-N
Synonyms
benzylbis(2-chloroethyl)amine hydrochloride N,N-Bis(2-chloroethyl)benzylamine hydrochloride N-benzylbis(2-chloroethyl)amine hydrochloride Embitol Benzenemethanamine, N,N-bis(2-chloroethyl)-, hydrochloride

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
6
H-bond acceptors
1
H-bond donors
1
Molar refractivity
70.41
TPSA
3.24

LogP / Solubility

WLOGP
3.39
MLOGP
2.99
XLogP3
3.39
Consensus LogP
3.26
Log S (ESOL)
-3.54
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.21
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.94
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)
-1.95

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral] H312 (33.3%): 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 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P316, 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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