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Home > Encyclopedia > 1,3-Dimethyl-3-buten-1-yl 2-hydroxybenzoate

1,3-Dimethyl-3-buten-1-yl 2-hydroxybenzoate

1,3-Dimethyl-3-buten-1-yl 2-hydroxybenzoate structure

1,3-Dimethyl-3-buten-1-yl 2-hydroxybenzoate 

structure
  • CAS No:

    80118-10-1

  • Formula:

    C13H16O3

  • Chemical Name:

    1,3-Dimethyl-3-buten-1-yl 2-hydroxybenzoate

  • Synonyms:

    Benzoic acid,2-hydroxy-,1,3-dimethyl-3-buten-1-yl ester;Benzoic acid,2-hydroxy-,1,3-dimethyl-3-butenyl ester;1,3-Dimethyl-3-buten-1-yl 2-hydroxybenzoate

1,3-Dimethyl-3-buten-1-yl 2-hydroxybenzoate Basic Attributes

220.26400

220.26

279-400-4

Characteristics

46.53000

2.90370

1.037g/cm3

319.3ºC at 760 mmHg

131ºC

1.506

Drug Information

1,3-dimethyl-3-butenyl salicylate

1,3-Dimethyl-3-buten-1-yl 2-hydroxybenzoate Use and Manufacturing

Benzoic acid, 2-hydroxy-, 1,3-dimethyl-3-buten-1-yl ester: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:220.26
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:220.109944368
Monoisotopic Mass:220.109944368
Topological Polar Surface Area:46.5
Heavy Atom Count:16
Complexity:260
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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