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Home > Encyclopedia > 1,3-Dimethylbutyl 2-butenoate

1,3-Dimethylbutyl 2-butenoate

1,3-Dimethylbutyl 2-butenoate structure

1,3-Dimethylbutyl 2-butenoate 

structure
  • CAS No:

    35206-51-0

  • Formula:

    C10H18O2

  • Chemical Name:

    1,3-Dimethylbutyl 2-butenoate

  • Synonyms:

    2-Butenoic acid,1,3-dimethylbutyl ester;1,3-Dimethylbutyl 2-butenoate;Frutinat

  • Categories:

    Cosmetic Ingredient  >  Perfuming

1,3-Dimethylbutyl 2-butenoate Basic Attributes

170.24900

170.25

252-438-9

DTXSID1052030

Characteristics

26.30000

2.54030

colorless to pale yellow clear liquid

0.889 g/cm3

204.6ºC at 760 mmHg

84.4ºC

1.436

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P321, P332+P313, and P362|Aggregated GHS information provided by 1560 companies from 1 notifications to the ECHA C&L Inventory.

1,3-Dimethylbutyl 2-butenoate Use and Manufacturing

Uses

Air care products

Production

< 25,000 lb

2-Butenoic acid, 1,3-dimethylbutyl ester: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:170.25
XLogP3:3.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:170.130679813
Monoisotopic Mass:170.130679813
Topological Polar Surface Area:26.3
Heavy Atom Count:12
Complexity:159
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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