CAS RN: 60079-51-8
H-PHG-NH2 HCL
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20250221 |
250mg |
Out of stock |
15 business days | Inquiry |
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Product code:
starshine_CAS60079-51-8
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Purity/Analytical Methods:
>99.0%
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60079-51-8 / 2-amino-N-phenylacetamide;hydrochloride
Standard CAS: 60079-51-8
Multi CAS: Yes
Basic Information
CAS
60079-51-8
Multi CAS
Yes
Molecular Formula
C8H11CLN2O
Molecular Weight
186.640000
Exact Mass
186.055991
InChI
InChI=1S/C8H10N2O.ClH/c9-7(8(10)11)6-4-2-1-3-5-6;/h1-5,7H,9H2,(H2,10,11);1H/t7-;/m0./s1
InChIKey
LXOAFHGMXCFTOU-FJXQXJEOSA-N
Physical Properties
Physical Description
2-aminoacetanilide hydrochloride is a black solid. (NTP, 1992)
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
51.37
TPSA
55.12
LogP / Solubility
WLOGP
1.01
MLOGP
0.88
XLogP3
1.01
Consensus LogP
0.97
Log S (ESOL)
-1.87
Class (ESOL)
Soluble
Log S (Ali)
-1.82
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.95
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)
-3.14
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5