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CAS 18218-20-7 1-(1-(4-CHLOROPHENYL)VINYL)BENZENE molecular structure lightbox
CAS RN: 18218-20-7

1-(1-(4-CHLOROPHENYL)VINYL)BENZENE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250804 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-083165
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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 18218-20-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞95% 0 Out of Stock Shanghai Inquiry

18218-20-7 / 1-chloro-4-(1-phenylethenyl)benzene

Standard CAS: 18218-20-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
18218-20-7
Multi CAS
No
Molecular Formula
C14H11Cl
Molecular Weight
214.690000
Exact Mass
214.054928
SMILES
C=C(C1=CC=CC=C1)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H11Cl/c1-11(12-5-3-2-4-6-12)13-7-9-14(15)10-8-13/h2-10H,1H2
InChIKey
QRSXZQQKWIHIHY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
12
Rotatable bonds
2
Molar refractivity
66.03
TPSA
0.0000

LogP / Solubility

WLOGP
4.4
MLOGP
3.88
XLogP3
5.6
Consensus LogP
4.63
Log S (ESOL)
-4.4
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.5
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.95
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.9

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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