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3-Bromo-5-methoxyphenol

3-Bromo-5-methoxyphenol structure

CAS No:
855400-66-7
Formula:
C7H7BrO2
Chemical Name:
3-Bromo-5-methoxyphenol
Synonyms:
3-Bromo-5-methoxyphenol 97%;3-Bromo-5-methoxyphenol; 855400-66-7;Phenol, 3-bromo-5-methoxy-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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3-Bromo-5-methoxyphenol Basic Attributes

Molecular Weight：

203.03

Exact Mass：

201.96294

DSSTox ID：

DTXSID00615719

HScode：

2909500000

Characteristics

PSA：

29.46000

XLogP3：

2.16330

Density：

1.585±0.06 g/cm3

Melting Point：

102 °C

Boiling Point：

277.4±20.0 °C(Predicted)

Flash Point：

121.5ºC

Refractive Index：

1.578

PKA：

8.63±0.10

Safety Information

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:203.03
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:201.96294
Monoisotopic Mass:201.96294
Topological Polar Surface Area:29.5
Heavy Atom Count:10
Complexity:108
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3-BROMO-5-METHOXYPHENOL

CAS No.: 855400-66-7

Content: 99.00%

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CAS No.: 855400-66-7

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Content: 97%

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