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CAS 1582-09-8 Trifluralin molecular structure lightbox
CAS RN: 1582-09-8

Trifluralin

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8 package records8 with current stock8 grade groups
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Batchno.20250610 1.2ml In stock Inquiry
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Batchno.20251008 1.2ml In stock Inquiry
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Batchno.20250409 1ml In stock Shanghai Inquiry
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Batchno.20250821 1ml In stock Shanghai, Shandong Inquiry
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Batchno.20260301 1ml In stock Shanghai Inquiry
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Batchno.20251230 10ml In stock Shanghai Inquiry
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Batchno.20260115 1ml In stock Shanghai Inquiry
  • Product code: SSC-066710
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ＞95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1582-09-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞95% 0 Out of Stock Shanghai Inquiry

1582-09-8 / 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline

Standard CAS: 1582-09-8 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1582-09-8
Multi CAS
No
Molecular Formula
C13H16F3N3O4
Molecular Weight
335.280000
Exact Mass
335.109290
SMILES
CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]
InChI
InChI=1S/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3
InChIKey
ZSDSQXJSNMTJDA-UHFFFAOYSA-N

Physical Properties

Melting Point
115 to 117 °F (NTP, 1992) 42 °C MP: 48.5-49 °C (technical >95%) 49 °C
Boiling Point
Decomposes (NTP, 1992) BP: 139-140 °C at 4.2 mm Hg at 0.5kPa: 139-140 °C
Density
1.294 at 77 °F (USCG, 1999) - Denser than water; will sink 1.36 at 22 °C Density (at 22 °C): 1.36 g/cm³
Physical Description
Trifluralin is a yellow-orange crystalline solid. Denser than water and not soluble in water. Hence sinks in water. Melting point 48.5-49 °C. Used as a selective pre-emergence herbicide. Yellow-orange solid; [Hawley] Odorless; [HSDB] ODOURLESS ORANGE CRYSTALS.
Appearance
Yellow crystals YELLOW-ORANGE PRISMS Orange crystalline solid
State
Solid
Storage Conditions
STORAGE PRECAUTIONS: You should protect this material from exposure to light, and store it in under ambient temperatures. (NTP, 1992) Provision to contain effluent from fire extinguishing. Separated from food and feedstuffs. Store only in original packaging. Store in an area without drain or sewer access. Do not store near heat or open flame. /Gowan Trifluralin 10G/ Do not contaminate water, food or feed by storage or disposal. ... Store in original bag only. /Gowan Trifluralin 10G/ This product is stable under normal storage conditions for a minimum of 3 yr when stored in adequate packing in metal containers with polyethylene lining, at room temp. The biological activity of digermin remains practically unvaried for 2 yr under environmental conditions, provided the product is stored in its unopened & undamaged original containers, & in shaded & possibly well-aired places. Avoid freezing. Store above 40 °F. Do not store near heat or flame.

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
6
Fraction Csp3
0.54
Rotatable bonds
7
H-bond acceptors
5
Molar refractivity
77.55
TPSA
89.52

LogP / Solubility

WLOGP
4.15
MLOGP
3.67
XLogP3
5.3
Consensus LogP
4.37
Log S (ESOL)
-4.26
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.3
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.12
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.82

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

Pictogram(s)
Irritant Health Hazard Environmental Hazard Acute Toxic
Signal
Warning Danger
GHS Hazard Statements
H317: May cause an allergic skin reaction [Warning Sensitization, Skin] H351: Suspected of causing cancer [Warning Carcinogenicity] H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] H410: Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard] H302 (25.8%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P203, P261, P272, P273, P280, P302+P352, P318, P321, P333+P317, P362+P364, P391, P405, and P501 P203, P260, P261, P264, P270, P271, P272, P273, P280, P284, P301+P317, P302+P352, P304+P340, P316, P318, P320, P321, P330, P333+P317, P362+P364, P391, P403+P233, P405, and P501 P203, P260, P261, P264, P270, P272, P280, P302+P352, P308+P316, P318, P319, P321, P333+P317, P362+P364, P405, and P501 P273, P391, and P501 P261, P264+P265, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P332+P317, P333+P317, P337+P317, P362+P364, and P501
Hazard Class/Division
9
Packing Group
III

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