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CAS 13674-84-5 Phosphoric acid tris(2-chloro-1-methylethyl) ester molecular structure lightbox
CAS RN: 13674-84-5

Phosphoric acid tris(2-chloro-1-methylethyl) ester

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260205 100g In stock Shanghai, Tianjin Inquiry
Batchno.20260204 1kg In stock Shanghai, Tianjin Inquiry
Batchno.20250730 25g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20251118 500g In stock Shanghai, Tianjin, Chengdu Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260522 25g / 100g / 500g / 2.5kg / 10kg Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei, Chongqing Inquiry
  • Product code: SSC-045747
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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: 100g
  • Available purity: ≥97%
  • 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 13674-84-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥97% 0 Out of Stock Hong Kong Inquiry

13674-84-5 / tris(1-chloropropan-2-yl) phosphate

Standard CAS: 13674-84-5 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
13674-84-5
Multi CAS
No
Molecular Formula
C9H18Cl3O4P
Molecular Weight
327.600000
Exact Mass
326.000829
SMILES
CC(CCl)OP(=O)(OC(C)CCl)OC(C)CCl
InChI
InChI=1S/C9H18Cl3O4P/c1-7(4-10)14-17(13,15-8(2)5-11)16-9(3)6-12/h7-9H,4-6H2,1-3H3
InChIKey
KVMPUXDNESXNOH-UHFFFAOYSA-N

Physical Properties

Melting Point
-42 °C
Boiling Point
235-248 °C
Density
Specific gravity: 1.29 at 25 °C
Physical Description
Tris(1-chloro-2-propyl) phosphate is a clear colorless viscous liquid. (NTP, 1992) Liquid Colorless viscous liquid; [CAMEO] Colorless liquid
Appearance
Clear, colorless liquid
State
Liquid
Storage Conditions
STORAGE PRECAUTIONS: You should store this material in a refrigerator. STORE AWAY FROM SOURCES OF IGNITION. (NTP, 1992)

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
1
Rotatable bonds
9
H-bond acceptors
4
Molar refractivity
71.41
TPSA
44.76

LogP / Solubility

WLOGP
4.03
MLOGP
3.56
XLogP3
2.6
Consensus LogP
3.4
Log S (ESOL)
-3.81
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.15
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.21
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.86

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

Safety & Transport

Pictogram(s)
Irritant Health Hazard
Signal
Warning
GHS Hazard Statements
H302 (99%): Harmful if swallowed [Warning Acute toxicity, oral] H351 (21.2%): Suspected of causing cancer [Warning Carcinogenicity] H412 (29.7%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard] H302: Harmful if swallowed [Warning Acute toxicity, oral] H336: May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects]
Precautionary Statement Codes
P203, P264, P270, P273, P280, P301+P317, P318, P330, P405, and P501 P203, P260, P261, P264, P270, P271, P273, P280, P301+P317, P304+P340, P308+P316, P318, P319, P330, P403+P233, P405, and P501 P203, P264, P270, P280, P301+P317, P318, P330, P405, and P501

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