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CAS 1186663-31-9 2-Amino-4-(chloromethyl)pyridine Hydrochloride molecular structure lightbox
CAS RN: 1186663-31-9

2-Amino-4-(chloromethyl)pyridine Hydrochloride

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260503 100mg In stock Inquiry
Batchno.20251006 1g In stock Inquiry
Batchno.20250312 250mg In stock Inquiry
Batchno.20260208 5g Out of stock Inquiry
  • Product code: SSC-018574
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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: 0.25g, 1g, 0.1g, 5g
  • Available purity: >97%
  • Inventory rows with stock: 2
  • 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 1186663-31-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >97% 3 In Stock Hong Kong Inquiry
1g >97% 2 In Stock Shanghai Inquiry
0.1g >97% 0 Out of Stock Beijing Inquiry
5g >97% 0 Out of Stock Shenzhen Inquiry

1186663-31-9 / 4-(chloromethyl)pyridin-2-amine;hydrochloride

2-AMINO-4-(CHLOROMETHYL)PYRIDINE HYDROCHLORIDE | 4-(Chloromethyl)pyridin-2-amine hydrochloride | 2-Amino-4-(chloromethyl)pyridine HCl

Standard CAS: 1186663-31-9 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1186663-31-9
Multi CAS
No
Molecular Formula
C6H8Cl2N2
Molecular Weight
179.040000
Exact Mass
178.006454
SMILES
C1=CN=C(C=C1CCl)N.Cl
InChI
InChI=1S/C6H7ClN2.ClH/c7-4-5-1-2-9-6(8)3-5;/h1-3H,4H2,(H2,8,9);1H
InChIKey
YFYBPPVXPGYHTE-UHFFFAOYSA-N
Synonyms
2-AMINO-4-(CHLOROMETHYL)PYRIDINE HYDROCHLORIDE 4-(Chloromethyl)pyridin-2-amine hydrochloride 2-Amino-4-(chloromethyl)pyridine HCl 4-(chloromethyl)pyridin-2-amine;hydrochloride MFCD12198864

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
45.45
TPSA
38.91

LogP / Solubility

WLOGP
1.82
MLOGP
1.6
XLogP3
1.82
Consensus LogP
1.75
Log S (ESOL)
-2.48
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.35
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.46
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)
-2.52

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger 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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501

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