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Dimethyl citraconate

Dimethyl citraconate structure

Dimethyl citraconate 

structure
  • CAS No:

    617-54-9

  • Formula:

    C7H10O4

  • Chemical Name:

    Dimethyl citraconate

  • Synonyms:

    2-Butenedioic acid,2-methyl-,1,4-dimethyl ester,(2Z)-;Citraconic acid,dimethyl ester;2-Butenedioic acid,2-methyl-,dimethyl ester,(Z)-;2-Butenedioic acid,2-methyl-,dimethyl ester,(2Z)-;Dimethyl citraconate;Methylmaleic acid,dimethyl ester;Dimethyl methylmaleate;cis-2-Methyl-2-butenedioic acid dimethyl ester

Dimethyl citraconate Basic Attributes

158.15200

158.15

2917190090

Characteristics

52.60000

0.27870

1.1097 g/cm3 @ Temp: 17.6 °C

210.5 °C

91.5ºC

1.438

Safety Information

36/37/38

26-36

Drug Information

dimethylcitraconate

Dimethyl citraconate Use and Manufacturing

2-Butenedioic acid, 2-methyl-, 1,4-dimethyl ester, (2Z)-: INACTIVE

Computed Properties

Molecular Weight:158.15
XLogP3:0.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:158.05790880
Monoisotopic Mass:158.05790880
Topological Polar Surface Area:52.6
Heavy Atom Count:11
Complexity:193
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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