SDF/Mol File of 3'-Methylacetanilide (C9H11NO)

Structure Data File (SDF/MOL File) Description

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Additional Information for Identifying 3'-Methylacetanilide Molecule

• Chemical structure of 3'-Methylacetanilide

  By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of 3'-Methylacetanilide is available in chemical structure page of 3'-Methylacetanilide, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.

• Molecular weight of 3'-Methylacetanilide

  The molecular weight of 3'-Methylacetanilide is available in molecular weight page of 3'-Methylacetanilide, which is calculated as the sum of the atomic masses of each constituent element multiplied by the number of atoms of that element.

• Chemical formula of 3'-Methylacetanilide

  The chemical formula of 3'-Methylacetanilide is given in chemical formula page of 3'-Methylacetanilide, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• InChI (IUPAC International Chemical Identifier) information of 3'-Methylacetanilide

  An alternative way of expressing structural information in text format is InChI. The full standard InChI of 3'-Methylacetanilide is:

  InChI=1S/C9H11NO/c1-7-4-3-5-9(6-7)10-8(2)11/h3-6H,1-2H3,(H,10,11)

  It can provide a standard way to encode the molecular information of 3'-Methylacetanilide to facilitate the search for the compound information in databases and on the web.

  The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of 3'-Methylacetanilide is:

  InChIKey=ALMHSXDYCFOZQD-UHFFFAOYSA-N

  The InChIKey may allow easier web searches for 3'-Methylacetanilide, but it needs to be linked to the full InChI to get back to the original structure of the 3'-Methylacetanilide since the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of 3'-Methylacetanilide

  The 3'-Methylacetanilide compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of 3'-Methylacetanilide including the registry numbers are listed below, if available:

  • C-52364
  • BBV-34549976
  • N-ACETYL-M-TOLUIDINE (SEE ALSO N-ACETYL-P-TOLUIDINE (103-89-9) & ACETYL-O-TOLUIDINE (120-66-1))
  • W-105708
  • AZ0001-0028
  • A0062
  • METHYL, [3-(ACETYLAMINO)PHENYL]-
  • L546
  • CAS-537-92-8
  • MFCD00014962

  • ANW-31852
  • KY86R0888B
  • HMS3039L06
  • Acetamide,N-(3-methylphenyl)-
  • N-(3-Tolyl)acetic acid amide
  • 3'-Methylacetanilide, 98%
  • meta-Acetotoluidide
  • (3-METHYLPHENYL)-ACETAMIDE
  • 3-ACETYLAMINOTOLUENE
  • ACETYL-M-TOLUIDINE

  • N-Acetoxy-3-toluidine
  • N1-(3-methylphenyl)acetamide
  • N-(m-tolyl)acetamide
  • N-Acetyl-n-toluidine
  • m-Methyl acetanilide
  • 1-Acetamido-3-methylbenzene
  • m-Acetotoluidine
  • N-Acetyl-3-methylaniline
  • m-Acetotolidide
  • Acetamide, N-(3-methylphenyl)-

  • Acetotoluide
  • m-Tolylacetamide
  • Aceto-m-aminotoluene
  • m-Methylacetanilide
  • N-m-Tolylacetamide
  • m-Acetotoluide
  • 3-Acetamidotoluene
  • 537-92-8
  • 3-Methylacetanilide
  • m-Acetotoluidide

  • N-Acetyl-m-toluidine
  • 3'-Methylacetanilide

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3'-Methylacetanilide Identification Summary Frequently Asked Questions (FAQs)

What’s the 3'-Methylacetanilide formula?
C9H11NO
How many atoms and what elements are included in the 3'-Methylacetanilide molecule?
22 atom(s) - 11 Hydrogen atom(s), 9 Carbon atom(s), 1 Nitrogen atom(s), and 1 Oxygen atom(s)
How many chemical bonds and what kind of bonds are in the 3'-Methylacetanilide structure?
22 bond(s) - 11 non-H bond(s), 7 multiple bond(s), 1 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), and 1 secondary amide(s) (aliphatic)
What’s the 3'-Methylacetanilide’s molar mass?
149.18974 g/mol
What’s the SMILES structure of 3'-Methylacetanilide?
CC(=O)Nc1cccc(C)c1
What’s the InChI code of 3'-Methylacetanilide?
InChI=1S/C9H11NO/c1-7-4-3-5-9(6-7)10-8(2)11/h3-6H,1-2H3,(H,10,11)
What’s the InChIKey format of 3'-Methylacetanilide?
ALMHSXDYCFOZQD-UHFFFAOYSA-N

71 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).