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CAS 17425-82-0 N-SEC-BUTYL(TRIMETHYLSILYL)AMI molecular structure lightbox
CAS RN: 17425-82-0

N-SEC-BUTYL(TRIMETHYLSILYL)AMI

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Batchno.20251211 5g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS17425-82-0
  • Purity/Analytical Methods: >99.0%
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17425-82-0 / N-trimethylsilylbutan-2-amine

Standard CAS: 17425-82-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
17425-82-0
Multi CAS
No
Molecular Formula
C7H19NSi
Molecular Weight
145.320000
Exact Mass
145.128676
SMILES
CCC(C)N[Si](C)(C)C
InChI
InChI=1S/C7H19NSi/c1-6-7(2)8-9(3,4)5/h7-8H,6H2,1-5H3
InChIKey
IBUPNBOPJGCOSP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
1
H-bond donors
1
Molar refractivity
46.23
TPSA
12.03

LogP / Solubility

WLOGP
2.21
MLOGP
1.94
XLogP3
2.21
Consensus LogP
2.12
Log S (ESOL)
-1.93
Class (ESOL)
Soluble
Log S (Ali)
-2.35
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.8
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)
-2.04

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
2

Safety & Transport

Pictogram(s)
Flammable Corrosive Irritant Environmental Hazard
Signal
Danger
GHS Hazard Statements
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids] H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation] H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P370+P378, P391, P403+P235, P405, and P501

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