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CAS 7522-27-2 3-CHLORO-N N-BIS(TRIMETHYLSILYL)ANILINE& molecular structure lightbox
CAS RN: 7522-27-2

3-CHLORO-N N-BIS(TRIMETHYLSILYL)ANILINE&

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250304 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS7522-27-2
  • Purity/Analytical Methods: >99.0%
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7522-27-2 / 3-chloro-N,N-bis(trimethylsilyl)aniline

Standard CAS: 7522-27-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
7522-27-2
Multi CAS
No
Molecular Formula
C12H22CLNSI2
Molecular Weight
271.930000
Exact Mass
271.097931
InChI
InChI=1S/C12H22ClNSi2/c1-15(2,3)14(16(4,5)6)12-9-7-8-11(13)10-12/h7-10H,1-6H3
InChIKey
QFZHUSXLYYOLGX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
1
Molar refractivity
80.62
TPSA
3.24

LogP / Solubility

WLOGP
4.82
MLOGP
4.25
XLogP3
4.82
Consensus LogP
4.63
Log S (ESOL)
-4.64
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.27
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.79
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.96

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

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