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CAS 10017-37-5 2-AMINO-2-METHYLPROPANE HYDROCHLORIDE molecular structure lightbox
CAS RN: 10017-37-5

2-AMINO-2-METHYLPROPANE HYDROCHLORIDE

  • Product code: SSC-000572
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 25g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 10017-37-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥95% 0 Out of Stock Shanghai Inquiry

10017-37-5 / 2-methylpropan-2-amine;hydrochloride

tert-Butylamine hydrochloride | tert-Butylammonium chloride | tert-Butylamine, hydrochloride

Standard CAS: 10017-37-5 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
10017-37-5
Multi CAS
Yes
Molecular Formula
C4H12ClN
Molecular Weight
109.600000
Exact Mass
109.065827
SMILES
CC(C)(C)N.Cl
InChI
InChI=1S/C4H11N.ClH/c1-4(2,3)5;/h5H2,1-3H3;1H
InChIKey
DLDIDQIZPBIVNQ-UHFFFAOYSA-N
Synonyms
tert-Butylamine hydrochloride tert-Butylammonium chloride tert-Butylamine, hydrochloride 7B1QGR5JY2 NSC-227859

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
31.19
TPSA
26.02

LogP / Solubility

WLOGP
1.17
MLOGP
1.01
XLogP3
1.17
Consensus LogP
1.12
Log S (ESOL)
-1.25
Class (ESOL)
Soluble
Log S (Ali)
-1.3
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.34
Class (SILICOS-IT)
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)
-2.56

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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