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CAS 14353-69-6 Benzenamine, N-hydroxy-2,4,6-trimethyl- molecular structure lightbox
CAS RN: 14353-69-6

Benzenamine, N-hydroxy-2,4,6-trimethyl-

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260621 100mg In stock Shanghai Inquiry
Batchno.20250314 1g In stock Shanghai Inquiry
Batchno.20260214 250mg In stock Shanghai Inquiry
Batchno.20250328 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260614 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS14353-69-6
  • Purity/Analytical Methods: >99.0%
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14353-69-6 / N-(2,4,6-trimethylphenyl)hydroxylamine

Standard CAS: 14353-69-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
14353-69-6
Multi CAS
No
Molecular Formula
C9H13NO
Molecular Weight
151.210000
Exact Mass
151.099714
SMILES
CC1=CC(=C(C(=C1)C)NO)C
InChI
InChI=1S/C9H13NO/c1-6-4-7(2)9(10-11)8(3)5-6/h4-5,10-11H,1-3H3
InChIKey
ZFYAPTBVXHEXOE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
46.06
TPSA
32.26

LogP / Solubility

WLOGP
2.41
MLOGP
2.12
XLogP3
2.5
Consensus LogP
2.34
Log S (ESOL)
-2.64
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.54
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.77
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)
-1.93

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

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