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CAS 1712-70-5 4-Chloro-alpha-methylstyrene molecular structure lightbox
CAS RN: 1712-70-5

4-Chloro-alpha-methylstyrene

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251013 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-075422
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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: 1g, 5g, 10g, 25g
  • Available purity: ≥97%
  • Inventory rows with stock: 4
  • 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 1712-70-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 2 In Stock Shanghai Inquiry
1g ≥97% 2 In Stock Beijing Inquiry
5g -- 2 In Stock Shanghai Inquiry
5g ≥97% 2 In Stock Shanghai Inquiry
10g -- 0 Out of Stock Beijing Inquiry
10g ≥97% 0 Out of Stock Beijing Inquiry
25g -- 0 Out of Stock Hong Kong Inquiry
25g ≥97% 0 Out of Stock Beijing Inquiry

1712-70-5 / 1-chloro-4-prop-1-en-2-ylbenzene

Standard CAS: 1712-70-5 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1712-70-5
Multi CAS
No
Molecular Formula
C9H9Cl
Molecular Weight
152.620000
Exact Mass
152.039278
SMILES
CC(=C)C1=CC=C(C=C1)Cl
InChI
InChI=1S/C9H9Cl/c1-7(2)8-3-5-9(10)6-4-8/h3-6H,1H2,2H3
InChIKey
WQDGTJOEMPEHHL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.11
Rotatable bonds
1
Molar refractivity
46.16
TPSA
0.0000

LogP / Solubility

WLOGP
3.37
MLOGP
2.96
XLogP3
4.4
Consensus LogP
3.58
Log S (ESOL)
-3.29
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.25
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.57
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.26

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant Environmental Hazard
Signal
Warning
GHS Hazard Statements
H227 (16.7%): Combustible liquid [Warning Flammable liquids] H315 (83.3%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (83.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (83.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H411 (33.3%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P210, P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403, P403+P233, P405, and P501

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