[email protected]
CAS 1166756-72-4 3-Bromo-5-chloro-2-methylaniline molecular structure lightbox
CAS RN: 1166756-72-4

3-Bromo-5-chloro-2-methylaniline

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250817 1g In stock Shanghai Inquiry
Batchno.20250407 1g In stock Inquiry
Batchno.20250831 250mg Out of stock 5-7 business days Inquiry
Batchno.20260515 250mg In stock Inquiry
Batchno.20250515 5g In stock Inquiry
  • Product code: SSC-016599
GET A QUOTE
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, 5g, 10g, 25g
  • Available purity: >97%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 1166756-72-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >97% 1 In Stock Hong Kong Inquiry
1g >97% 1 In Stock Hong Kong Inquiry
5g >97% 0 Out of Stock Beijing Inquiry
10g >97% 0 Out of Stock Shanghai Inquiry
25g >97% 0 Out of Stock Hong Kong Inquiry

1166756-72-4 / 3-bromo-5-chloro-2-methylaniline

3-BROMO-5-CHLORO-2-METHYLANILINE | MFCD12198860 | Benzenamine, 3-bromo-5-chloro-2-methyl-

Standard CAS: 1166756-72-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1166756-72-4
Multi CAS
No
Molecular Formula
C7H7BrClN
Molecular Weight
220.490000
Exact Mass
218.945040
SMILES
CC1=C(C=C(C=C1Br)Cl)N
InChI
InChI=1S/C7H7BrClN/c1-4-6(8)2-5(9)3-7(4)10/h2-3H,10H2,1H3
InChIKey
BGECTFQDFFAMKV-UHFFFAOYSA-N
Synonyms
3-BROMO-5-CHLORO-2-METHYLANILINE MFCD12198860 Benzenamine, 3-bromo-5-chloro-2-methyl- 3-bromo-5-chloro-2-methyl-aniline SCHEMBL1494549

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.14
H-bond acceptors
1
H-bond donors
1
Molar refractivity
48.3
TPSA
26.02

LogP / Solubility

WLOGP
2.99
MLOGP
2.64
XLogP3
2.9
Consensus LogP
2.84
Log S (ESOL)
-3.54
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.53
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.58
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.94

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (100%): 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 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us