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Methyl 4′-bromo[1,1′-biphenyl]-4-carboxylate

Methyl 4′-bromo[1,1′-biphenyl]-4-carboxylate structure

CAS No:
89901-03-1
Formula:
C14H11BrO2
Chemical Name:
Methyl 4′-bromo[1,1′-biphenyl]-4-carboxylate
Synonyms:
[1,1′-Biphenyl]-4-carboxylic acid,4′-bromo-,methyl ester;Methyl 4′-bromo[1,1′-biphenyl]-4-carboxylate;Methyl 4′-bromobiphenyl-4-carboxylate;4′-Bromobiphenyl-4-carboxylic acid methyl ester
Categories:
Chemical Reagents > Organic Reagents

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Methyl 4′-bromo[1,1′-biphenyl]-4-carboxylate Basic Attributes

Molecular Weight：

291.14

Exact Mass：

291.14

DSSTox ID：

DTXSID30353273

Characteristics

PSA：

26.3 Å²

Density：

1.394±0.06 g/cm3

Melting Point：

144-146 °C

Boiling Point：

382.7±25.0 °C(Predicted)

Water Solubility：

Slightly soluble in water.

Safety Information

Hazard category：

IRRITANT

Transport codes：

UN 3077 9 / PGIII

wgk germany：

hazard class code：

36/37/38-50/53-41

safety instructions：

26-36/37/39-61-60-39

Marks：

Xi,N

GHS Classification：

|Danger|H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|P273, P280, P305+P351+P338, P310, P391, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:291.14
XLogP3:4.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:289.99424
Monoisotopic Mass:289.99424
Topological Polar Surface Area:26.3
Heavy Atom Count:17
Complexity:251
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 89901-03-1

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Guide of Methyl 4′-bromo[1,1′-biphenyl]-4-carboxylate

Basic Attributes
Characteristics
Safety Information
Computed Properties
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