CAS RN: 53-19-0
Mitotane
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12 package records4 with current stock11 grade groups
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| Batchno.20251031 |
1ml |
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| 8-10 business days | Inquiry |
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| Batchno.20250820 |
1ml |
Out of stock |
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| Batchno.20250221 |
1ml |
Out of stock |
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| Batchno.20250517 |
1ml |
Out of stock |
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| Batchno.20260506 |
1ml |
Out of stock |
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| Batchno.20250921 |
1ml |
Out of stock |
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| Batchno.20251127 |
10ml |
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| Batchno.20260111 |
1ml |
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| Batchno.20260515 |
1g / 5g / 25g / 100g |
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Shanghai, Shandong, Guangdong | | Inquiry |
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| Batchno.20260109 |
100mg |
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| Batchno.20251201 |
1g |
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| Batchno.20250809 |
5g |
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Product code:
ICTM3304
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Purity/Analytical Methods:
>98.0%(GC)
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53-19-0 / 1-chloro-2-[2,2-dichloro-1-(4-chlorophenyl)ethyl]benzene
Standard CAS: 53-19-0
Multi CAS: Yes
Basic Information
CAS
53-19-0
Multi CAS
Yes
Molecular Formula
C14H10CL4
Molecular Weight
320.000000
Exact Mass
319.950711
InChI
InChI=1S/C14H10Cl4/c15-10-7-5-9(6-8-10)13(14(17)18)11-3-1-2-4-12(11)16/h1-8,13-14H
InChIKey
JWBOIMRXGHLCPP-UHFFFAOYSA-N
Physical Properties
Melting Point
171 to 172 °F (NTP, 1992)
77 °C
Physical Description
O,p'-ddd is a colorless powder. (NTP, 1992)
Solid
Appearance
Crystals from pentane or methanol
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.14
Rotatable bonds
3
Molar refractivity
80.24
TPSA
0.0000
LogP / Solubility
WLOGP
5.93
MLOGP
5.23
XLogP3
6.2
Consensus LogP
5.79
Log S (ESOL)
-5.85
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.47
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.02
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.46
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2