CAS RN: 1212104-62-5
(1R)-1-(5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)ETHAN-1-AMINE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250204 | 10mg / 50mg / 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1212104-62-5
- Purity/Analytical Methods: >99.0%
1212104-62-5 / (1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
1-(5,6,7,8-Tetrahydro-naphthalen-2-yl)-ethylamine | 1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine | MFCD06655766
Basic Information
CAS
1212104-62-5
Multi CAS
Yes
Molecular Formula
C12H17N
Molecular Weight
175.270000
Exact Mass
175.136100
SMILES
C[C@H](C1=CC2=C(CCCC2)C=C1)N
InChI
InChI=1S/C12H17N/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h6-9H,2-5,13H2,1H3/t9-/m1/s1
InChIKey
YJZYMMDEDLLIIP-SECBINFHSA-N
Synonyms
1-(5,6,7,8-Tetrahydro-naphthalen-2-yl)-ethylamine
1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
MFCD06655766
1-(5,6,7,8-tetrahydro-2-naphthalenyl)ethanamine
1-(2-5,6,7,8-tetrahydronaphthyl)ethylamine
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
55.69
TPSA
26.02
LogP / Solubility
WLOGP
2.59
MLOGP
2.27
XLogP3
2.6
Consensus LogP
2.49
Log S (ESOL)
-2.83
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.86
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.06
Class (SILICOS-IT)
Poorly 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)
-1.95
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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