CAS RN: 18501-20-7

1-hydrazino-2-propanol(SALTDATA: FREE)

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Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260318 100mg / 250mg Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS18501-20-7
  • Purity/Analytical Methods: >99.0%
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18501-20-7 / 1-hydrazinylpropan-2-ol

Standard CAS: 18501-20-7 Multi CAS: No

Basic Information

CAS
18501-20-7
Multi CAS
No
Molecular Formula
C3H10N2O
Molecular Weight
90.120000
Exact Mass
90.079313
SMILES
CC(CNN)O
InChI
InChI=1S/C3H10N2O/c1-3(6)2-5-4/h3,5-6H,2,4H2,1H3
InChIKey
OWXTVVMIMIRMLL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
3
Molar refractivity
23.87
TPSA
58.28

LogP / Solubility

WLOGP
-1.17
MLOGP
-1.04
XLogP3
-1.2
Consensus LogP
-1.14
Log S (ESOL)
0.47
Class (ESOL)
Highly soluble
Log S (Ali)
0.55
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.48
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.1

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)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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