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CAS 8004-13-5 PHENYL ETHER-BIPHENYL EUTECTIC molecular structure lightbox
CAS RN: 8004-13-5

PHENYL ETHER-BIPHENYL EUTECTIC

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260603 25g / 100g / 500g / 2.5kg Confirm by inquiry Shandong, Chongqing, Shanghai Inquiry
  • Product code: SSC-189045
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 100ml, 500ml, 1000ml
  • Available purity: approximately 70% : 30%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 8004-13-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
100ml approximately 70% : 30% 5 In Stock Shenzhen Inquiry
500ml approximately 70% : 30% 5 In Stock Hong Kong Inquiry
1000ml approximately 70% : 30% 5 In Stock Beijing Inquiry

8004-13-5 / 1,1'-biphenyl;phenoxybenzene

Standard CAS: 8004-13-5 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
8004-13-5
Multi CAS
No
Molecular Formula
C24H20O
Molecular Weight
324.400000
Exact Mass
324.151415
InChI
InChI=1S/C12H10O.C12H10/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H;1-10H
InChIKey
MHCVCKDNQYMGEX-UHFFFAOYSA-N

Physical Properties

Melting Point
54 °F (USCG, 1999) 12.2 °C 54 °F
Boiling Point
494 °F at 760 mmHg (USCG, 1999) 257 °C 495 °F
Density
1.06 at 69.8 °F (USCG, 1999) - Denser than water; will sink 1.06 @ 25 °C/25 °C (77 °F): 1.06
Physical Description
Dowtherm appears as light to dark brown fragrant liquid. May float or sink in water. Freezing point is 54 °F. (USCG, 1999) Colorless to straw-colored liquid or solid (below 54 degrees F) with a disagreeable, aromatic odor. [Note: A mixture typically contains 75% phenyl ether & 25% biphenyl.]; [NIOSH] Colorless to straw-colored liquid or solid (below 54 °F) with a disagreeable, aromatic odor. [Note: A mixture typically contains 75% phenyl ether & 25% biphenyl.]
Appearance
Colorless to straw-colored liquid or solid (below 54 degrees F) ... [Note: A mixture typically contains 75% phenyl ether & 25% biphenyl].
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
24
Rotatable bonds
3
H-bond acceptors
1
Molar refractivity
104.84
TPSA
9.23

LogP / Solubility

WLOGP
6.83
MLOGP
6.03
XLogP3
6.83
Consensus LogP
6.56
Log S (ESOL)
-6.67
Class (ESOL)
Insoluble
Log S (Ali)
-7.15
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.8
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)
0.15

Drug-likeness / Medicinal Chemistry

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

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