CAS RN: 291765-95-2
CARBENDAZIM D4
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.20260515 | 10mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS291765-95-2
- Purity/Analytical Methods: >99.0%
291765-95-2 / methyl N-(1H-benzimidazol-2-yl)carbamate
Basic Information
CAS
291765-95-2
Multi CAS
Yes
Molecular Formula
C9H9N3O2
Molecular Weight
191.190000
Exact Mass
191.069477
InChI
InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)
InChIKey
TWFZGCMQGLPBSX-UHFFFAOYSA-N
Physical Properties
Melting Point
576 to 585 °F (decomposes) (NTP, 1992)
Decomposes at 300 °C
MP: 302-307 °C (decomposes)
302 - 307 °C
Density
1.45 at 68 °F (NTP, 1992) - Denser than water; will sink
1.45 g/cu cm at 25 °C
0.27 g/cm³
Physical Description
Carbendazim appears as light gray or beige powder. (NTP, 1992)
White to light-gray, odorless solid; [HSDB] Powder;
Solid
COLOURLESS CRYSTALS OR GREY-TO-WHITE POWDER.
Appearance
White powder
Crystalline powder
Nearly white solid /Technical/
Light-gray powder
Off-white, crystalline powder
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
52.12
TPSA
67.01
LogP / Solubility
WLOGP
1.74
MLOGP
1.53
XLogP3
1.5
Consensus LogP
1.59
Log S (ESOL)
-2.53
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.38
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.47
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.65
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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