CAS RN: 63430-96-6
2-hydroxyMethyl-1,2,3,4-tetrahydroquinoline
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20260504 |
100mg / 250mg / 1g |
Out of stock |
5-7 business days | Inquiry |
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Product code:
starshine_CAS63430-96-6
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Purity/Analytical Methods:
>99.0%
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63430-96-6 / [(2S)-1,2,3,4-tetrahydroquinolin-2-yl]methanol
Standard CAS: 63430-96-6
Multi CAS: Yes
Basic Information
CAS
63430-96-6
Multi CAS
Yes
Molecular Formula
C10H13NO
Molecular Weight
163.220000
Exact Mass
163.099714
InChI
InChI=1S/C10H13NO/c12-7-9-6-5-8-3-1-2-4-10(8)11-9/h1-4,9,11-12H,5-7H2/t9-/m0/s1
InChIKey
QSDYZRIUFBMUGV-VIFPVBQESA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
49.26
TPSA
32.26
LogP / Solubility
WLOGP
1.41
MLOGP
1.23
XLogP3
1.7
Consensus LogP
1.45
Log S (ESOL)
-2.04
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.91
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.01
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)
-2.72
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2