CAS RN: 1177299-74-9
3-ethylpiperidin-3-ol
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.20260302 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1177299-74-9
- Purity/Analytical Methods: >99.0%
1177299-74-9 / 3-ethylpiperidin-3-ol
3-Ethylpiperidin-3-ol | DTXSID20672420 | RefChem:279285
Basic Information
CAS
1177299-74-9
Multi CAS
No
Molecular Formula
C7H15NO
Molecular Weight
129.200000
Exact Mass
129.115364
SMILES
CCC1(CCCNC1)O
InChI
InChI=1S/C7H15NO/c1-2-7(9)4-3-5-8-6-7/h8-9H,2-6H2,1H3
InChIKey
NLVBTAUKMSPTEZ-UHFFFAOYSA-N
Synonyms
3-Ethylpiperidin-3-ol
DTXSID20672420
RefChem:279285
DTXCID70623169
889-140-9
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
37.34
TPSA
32.26
LogP / Solubility
WLOGP
0.51
MLOGP
0.44
XLogP3
0.4
Consensus LogP
0.45
Log S (ESOL)
-0.9
Class (ESOL)
Very soluble
Log S (Ali)
-0.99
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.04
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)
-3.15
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Safety & Transport
Pictogram(s)
Corrosive
Irritant
Signal
Danger
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501
Customers Also Viewed
-
4-(1-aminoethyl)benzonitrile hydrochloride
- CAS RN: 1177316-44-7
- Product Code: starshine_CAS1177316-44-7
- Purity/Analytical method: >99.0%
-
(2-methoxy-1,1-dimethylethyl)methylamine(SALTDATA: 1HCl 0.15H2O)
- CAS RN: 1177316-77-6
- Product Code: SSC-017569
-
-
5-[(2-CHLOROPHENOXY)METHYL]-4-METHYL-4H-1,2,4-TRIAZOLE-3-THIOL
- CAS RN: 1177318-36-3
- Product Code: SSC-017571
-
(CyclohexylMethyl)hydrazine dihydrochloride
- CAS RN: 1177319-00-4
- Product Code: SSC-017572
-
Hexahydro-cyclopenta[c]pyrrole-2,5-dicarboxylic acid mono-tert-butyl ester
- CAS RN: 1177319-91-3
- Product Code: SSC-017573
![CAS 1177318-36-3 5-[(2-CHLOROPHENOXY)METHYL]-4-METHYL-4H-1,2,4-TRIAZOLE-3-THIOL molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB1731167.gif)
![CAS 1177319-91-3 Hexahydro-cyclopenta[c]pyrrole-2,5-dicarboxylic acid mono-tert-butyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1177319-91-3.gif)