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CAS 12015-14-4 AMMONIUM CHLORIDE-D4 molecular structure lightbox
CAS RN: 12015-14-4

AMMONIUM CHLORIDE-D4

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250718 10g In stock Inquiry
Batchno.20260618 1g In stock Inquiry
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  • Product code: starshine_CAS12015-14-4
  • Purity/Analytical Methods: >99.0%
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12015-14-4 / tetradeuterioazanium chloride

DTXSID80904714 | RefChem:319487 | DTXCID101333823

Standard CAS: 12015-14-4 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
12015-14-4
Multi CAS
Yes
Molecular Formula
ClH4N
Molecular Weight
57.510000
Exact Mass
57.028334
SMILES
[2H][N+]([2H])([2H])[2H].[Cl-]
InChI
InChI=1S/ClH.H3N/h1H;1H3/i/hD4
InChIKey
NLXLAEXVIDQMFP-JBISRTOLSA-N
Synonyms
DTXSID80904714 RefChem:319487 DTXCID101333823 Ammonium-d4 chloride Ammonium Chloride-d4

Computed Properties

Structural Parameters

Heavy atom count
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
5.98
TPSA
36.5

LogP / Solubility

WLOGP
-2.62
MLOGP
-2.32
XLogP3
-2.62
Consensus LogP
-2.52
Log S (ESOL)
1.48
Class (ESOL)
Highly soluble
Log S (Ali)
1.89
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
2.17
Class (SILICOS-IT)
Highly 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)
-4.91

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501

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