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Home > Encyclopedia > 2,2-Dimethyl-4-pentenoic acid

2,2-Dimethyl-4-pentenoic acid

2,2-Dimethyl-4-pentenoic acid structure

2,2-Dimethyl-4-pentenoic acid 

structure
  • CAS No:

    16386-93-9

  • Formula:

    C7H12O2

  • Chemical Name:

    2,2-Dimethyl-4-pentenoic acid

  • Synonyms:

    4-Pentenoic acid,2,2-dimethyl-;2,2-Dimethyl-4-pentenoic acid;2,2-Dimethylpent-4-enoic acid

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

2,2-dimethyl-4-pentenoic acid is a methyl-branched fatty acid.

2,2-Dimethyl-4-pentenoic acid Basic Attributes

128.17 g/mol

128.17

8CR4G8F32N

DTXSID00167667

Characteristics

37.3 Ų

103-105 °C @ Press: 10 Torr

Safety Information

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 41 companies from 4 notifications to the ECHA C&L Inventory.

2,2-Dimethyl-4-pentenoic acid Use and Manufacturing

Fatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Branched fatty acids [FA0102]

Computed Properties

Molecular Weight:128.17
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:128.083729621
Monoisotopic Mass:128.083729621
Topological Polar Surface Area:37.3
Heavy Atom Count:9
Complexity:125
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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