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CAS 1777-82-8 2,4-Dichlorobenzyl Alcohol molecular structure lightbox
CAS RN: 1777-82-8

2,4-Dichlorobenzyl Alcohol

  • Product code: SSC-077675
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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: 5g, 10g, 25g, 100g, 500g
  • Available purity: ≥98%
  • Inventory rows with stock: 5
  • 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 1777-82-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 5 In Stock Shanghai Inquiry
10g ≥98% 5 In Stock Beijing Inquiry
25g ≥98% 5 In Stock Beijing Inquiry
100g ≥98% 5 In Stock Shenzhen Inquiry
500g ≥98% 3 In Stock Shanghai Inquiry

1777-82-8 / (2,4-dichlorophenyl)methanol

Standard CAS: 1777-82-8 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1777-82-8
Multi CAS
No
Molecular Formula
C7H6Cl2O
Molecular Weight
177.020000
Exact Mass
175.979570
SMILES
C1=CC(=C(C=C1Cl)Cl)CO
InChI
InChI=1S/C7H6Cl2O/c8-6-2-1-5(4-10)7(9)3-6/h1-3,10H,4H2
InChIKey
DBHODFSFBXJZNY-UHFFFAOYSA-N

Physical Properties

Melting Point
55-58 ºC

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
42.38
TPSA
20.23

LogP / Solubility

WLOGP
2.49
MLOGP
2.18
XLogP3
2.5
Consensus LogP
2.39
Log S (ESOL)
-2.88
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.81
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.99
Class (SILICOS-IT)
Moderately 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)
-2.04

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)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H318 (31.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H332 (28.7%): Harmful if inhaled [Warning Acute toxicity, inhalation] H412 (96.8%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P261, P264+P265, P271, P273, P280, P304+P340, P305+P354+P338, P317, and P501

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