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Amyl isobutyrate

Amyl isobutyrate structure

Amyl isobutyrate 

structure
  • CAS No:

    2445-72-9

  • Formula:

    C9H18O2

  • Chemical Name:

    Amyl isobutyrate

  • Synonyms:

    Propanoic acid,2-methyl-,pentyl ester;Isobutyric acid,pentyl ester;Amyl isobutyrate;Pentyl isobutyrate;Pentyl 2-methylpropionate;2-Methylpropionic acid pentyl ester;Pentyl 2-methylpropanoate;n-Pentyl 2-methylpropanoate;Pentyl isobutanoate

  • Categories:

    Cosmetic Ingredient  >  Perfuming

Amyl isobutyrate Basic Attributes

158.24

158.24

219-494-6

7UEX06WJZW

DTXSID5074341

2915900090

Characteristics

26.3

3.18

0.9±0.1 g/cm3

-73°C (estimate)

108-113 °C @ Press: 11 Torr

59.4±8.3 °C

1.417

1.09mmHg at 25°C

Safety Information

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, P501

H226

Not Classified

Amyl isobutyrate Use and Manufacturing

Propanoic acid, 2-methyl-, pentyl ester: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Food additives -> Flavoring Agents

Flavoring Agents

Computed Properties

Molecular Weight:158.24
XLogP3:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:158.130679813
Monoisotopic Mass:158.130679813
Topological Polar Surface Area:26.3
Heavy Atom Count:11
Complexity:108
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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