4-Methylpentanoic acid methyl ester

CAS Registry Number®

2412-80-8

CAS Name

4-Methylpentanoic acid methyl ester

Molecular Formula

C7H14O2

Molecular Mass

130.18

Cite this Page

4-Methylpentanoic acid methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2412-80-8 (retrieved 2024-11-21) (CAS RN: 2412-80-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    58 °C @ Press: 14 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H14O2/c1-6(2)4-5-7(8)9-3/h6H,4-5H2,1-3H3

InChIKey

InChIKey=KBCOVKHULBZKNY-UHFFFAOYSA-N

SMILES

C(CCC(C)C)(OC)=O

Canonical SMILES

O=C(OC)CCC(C)C

Other Names for this Substance

  • Pentanoic acid, 4-methyl-, methyl ester
  • Valeric acid, 4-methyl-, methyl ester
  • Methyl 4-methylvalerate
  • Methyl 4-methylpentanoate
  • Methyl isohexanoate

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CAS INSIGHTSTM
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