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2-Chloro-6-methylphenol

2-Chloro-6-methylphenol structure

CAS No:
87-64-9
Formula:
C7H7ClO
Chemical Name:
2-Chloro-6-methylphenol
Synonyms:
Phenol,2-chloro-6-methyl-;o-Cresol,6-chloro-;2-Chloro-6-methylphenol;6-Chloro-o-cresol;2-Methyl-6-chlorophenol;6-Chloro-2-methylphenol;3-Chloro-2-hydroxytoluene;NSC 2878;28177-55-1
Categories:
Pharmaceutical Intermediates > Ophthalmic Agents

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Description

Coloroless to yellow liquid

2-Chloro-6-methylphenol Basic Attributes

Molecular Weight：

142.582

Exact Mass：

142.58

EC Number：

201-760-8

NSC Number：

2878

DSSTox ID：

DTXSID0075362

Characteristics

PSA：

20.2

XLogP3：

2.8

Appearance：

Coloroless to yellow liquid

Density：

1.1950 g/cm³ @ Temp: 25 °C

Melting Point：

130 °C

Boiling Point：

189 °C

Flash Point：

75.0±21.8 °C

Refractive Index：

1.566

Water Solubility：

Soluble in water (24 mg/ml at 25°C).

Safety Information

Packing level：

Ⅱ

Hazard category：

6.1

Transport codes：

2669

hazard class code：

6.1

safety instructions：

S26-S28-S36/37/39-S23

RTECS Number：

GO7120100

Marks：

Xi: Irritant;Xn: Harmful;

Precautionary statement(s)：

P260, P261, P264, P270, P271, P273, P280, P301+P310, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P311, P312, P321, P322, P330, P332+P313, P361, P362, P363, P391, P403+P233, P405, P501

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (33.33%): Toxic if swallowed [Danger Acute toxicity, oral]|P260, P261, P264, P270, P271, P273, P280, P301+P310, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P311, P312, P321, P322, P330, P332+P313, P361, P362, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

6-chloro-o-cresol

2-Chloro-6-methylphenol Use and Manufacturing

General procedure: o-Cresol (melted) or m-cresol (5.41 g, 50.0 mmol), AlCl3 (0.25 g) and the catalyst (100 mg)were added to a dried 50 ml round-bottomed flask. Sulfuryl chloride (4.66 ml, 57.7 mmol) wasthen added slowly over 2 h via a pressure-equalizing dropping funnel. The reaction mixture wasstirred for 2 h before being quenched with water (20 ml). The reaction mixture was worked up, and the crude products were weighed until constant mass and then analyzed by quantitative GC.Freshly distilled sulfuryl chloride (4.66 mL, 57.7 mmol) was added slowly over 2 h to a mixture of o-cresol or m-cresol (5.41 g, 50 mmol), AlCl

Computed Properties

Molecular Weight:142.58
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:142.0185425
Monoisotopic Mass:142.0185425
Topological Polar Surface Area:20.2
Heavy Atom Count:9
Complexity:94.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 2-Chloro-6-methylphenol

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2-Chloro-6-methylphenol (6-Chloro-o-cresol)

CAS No.: 87-64-9

Content: 99.00%

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QUANHUI BIO Contact Supplier

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1 YR

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2-CHLORO-6-METHYLPHENOL

Unit Price: $100 /KG EXW

CAS No.: 87-64-9

Grade: Pharmaceutical Grade

Content: 99%

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