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CAS 149358-73-6 CHLORAMINE-T HYDRATE molecular structure lightbox
CAS RN: 149358-73-6

CHLORAMINE-T HYDRATE

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6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260225 100g In stock Inquiry
Batchno.20250225 2.5kg In stock Inquiry
Batchno.20260419 25g In stock Inquiry
Batchno.20251207 500g In stock Inquiry
Batchno.20250518 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260204 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Chongqing Inquiry
  • Product code: starshine_CAS149358-73-6
  • Purity/Analytical Methods: >99.0%
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149358-73-6 / sodium;chloro-(4-methylphenyl)sulfonylazanide;hydrate

Standard CAS: 149358-73-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
149358-73-6
Multi CAS
No
Molecular Formula
C7H9ClNNaO3S
Molecular Weight
245.660000
Exact Mass
244.988936
SMILES
CC1=CC=C(C=C1)S(=O)(=O)[N-]Cl.O.[Na+]
InChI
InChI=1S/C7H7ClNO2S.Na.H2O/c1-6-2-4-7(5-3-6)12(10,11)9-8;;/h2-5H,1H3;;1H2/q-1;+1;
InChIKey
BXSDMMPOQRECKB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
51.19
TPSA
79.74

LogP / Solubility

WLOGP
-1.61
MLOGP
-1.41
XLogP3
-1.61
Consensus LogP
-1.54
Log S (ESOL)
-0.53
Class (ESOL)
Very soluble
Log S (Ali)
-0.41
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.16
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.36

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive Irritant Health Hazard
Signal
Danger
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H334 (100%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]
Precautionary Statement Codes
P233, P260, P264, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P342+P316, P363, P403, P405, and P501

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