[email protected]
CAS 1720-32-7 1,6-DIPHENYL-1,3,5-HEXATRIENE molecular structure lightbox
CAS RN: 1720-32-7

1,6-DIPHENYL-1,3,5-HEXATRIENE

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260413 100mg In stock Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batchno.20251203 1g In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20250407 500mg In stock Shanghai, Shandong, Chongqing, Hebei Inquiry
Batchno.20250208 5g In stock Shandong Inquiry
  • Product code: starshine_CAS1720-32-7
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1720-32-7 / [(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]benzene

Standard CAS: 1720-32-7 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1720-32-7
Multi CAS
No
Molecular Formula
C18H16
Molecular Weight
232.300000
Exact Mass
232.125201
SMILES
C1=CC=C(C=C1)/C=C/C=C/C=C/C2=CC=CC=C2
InChI
InChI=1S/C18H16/c1(5-11-17-13-7-3-8-14-17)2-6-12-18-15-9-4-10-16-18/h1-16H/b2-1+,11-5+,12-6+
InChIKey
BOBLSBAZCVBABY-WPWUJOAOSA-N

Physical Properties

Physical Description
Light yellow crystalline solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Rotatable bonds
4
Molar refractivity
80.09
TPSA
0.0000

LogP / Solubility

WLOGP
4.97
MLOGP
4.38
XLogP3
6.1
Consensus LogP
5.15
Log S (ESOL)
-4.64
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.05
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.77
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)
-0.61

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (98.6%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (98.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us