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[1,1'-BIPHENYL] 3,5-DICARBOXYLIC ACID DEMETHYL ESTER

[1,1'-BIPHENYL] 3,5-DICARBOXYLIC ACID DEMETHYL ESTER structure

CAS No:
21991-00-4
Formula:
C16H14O4
Chemical Name:
[1,1'-BIPHENYL] 3,5-DICARBOXYLIC ACID DEMETHYL ESTER
Synonyms:
dimethyl biphenyl-3,5-dicarboxylate;dimethyl 5-phenylisophthalate;[1,1"-Biphenyl] 3,5-dicarboxylic acid demethyl ester;[1,1"-Biphenyl]3,5-dicarboxylic acid demethyl ester;Dimethyl 5-phenylbenzene-1,3-dicarboxylate;SCHEMBL7823750;DTXSID30401607;ZINC393048;AKOS005266189;5-Phenylisophthalic acid dimethyl ester

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[1,1'-BIPHENYL] 3,5-DICARBOXYLIC ACID DEMETHYL ESTER Basic Attributes

Molecular Weight：

270.28

Exact Mass：

270.08900

DSSTox ID：

DTXSID30401607

HScode：

2917399090

Characteristics

PSA：

52.6

XLogP3：

2.92680

Density：

1.172g/cm3

Boiling Point：

423.8ºC at 760 mmHg

Flash Point：

215.1ºC

Refractive Index：

1.558

Safety Information

Precautionary statement(s)：

P273, P391, P501

Hazard Statements：

H400

GHS Classification：

|Warning|H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|P273, P391, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:270.28
XLogP3:3.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:270.08920892
Monoisotopic Mass:270.08920892
Topological Polar Surface Area:52.6
Heavy Atom Count:20
Complexity:322
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [1,1'-BIPHENYL] 3,5-DICARBOXYLIC ACID DEMETHYL ESTER

Basic Attributes
Characteristics
Safety Information
Computed Properties
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[1,1'-BIPHENYL] 3,5-DICARBOXYLIC ACID DEMETHYL ESTER

SDS

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