N-Acetyl-L-valine

CAS 96-81-1  ·  C7H13NO3  ·  MW 159.18 g/mol

Full record: N-Acetyl-L-valine — Safety Data Sheet →

Loading molecule...
3D model N-Acetyl-L-valine, CAS 96-81-1, molecular formula C7H13NO3, molar mass 159.18 g/mol

Model views

  • N-Acetyl-L-valine (CAS 96-81-1) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • N-Acetyl-L-valine (CAS 96-81-1) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • N-Acetyl-L-valine (CAS 96-81-1) – 2D structure, MolGod Viewer
    2D structure

© 2026 MolGod.org. All rights reserved. · Image rights

🖨️ 3D print model & licenseMolGod_Print3D_1
N-Acetyl-L-valine, C7H13NO3, CAS 96-81-1 - 3D molecular model
© MolGod.org — All rights reserved · image rights

MG_629-468-302-19 · engraved · 398,992 △ · 19 MB · SHA-256 a23c2479c019b487

Download 3D model: N-Acetyl-L-valine, C7H13NO3, CAS 96-81-1 · ENGRAVED (C, H, N, O) · 19 MB

N-Acetyl-L-valine (CAS 96-81-1), C7H13NO3 - 3D ball-and-stick molecular model, MolGod STL previewDownload image

MG_629-468-302-19 · normal · 10,080 △ · 492 KB · SHA-256 4f16bd05297470a4

Download 3D model: N-Acetyl-L-valine, C7H13NO3, CAS 96-81-1 · NORMAL · 492 KB

License & provenance ↓

⚠️ The MolGod.org name and logo, including the raised logo on the base, are our trademark. The CC BY-SA 4.0 licence does not cover trademarks (section 2(b)(2)). Do not use the MolGod.org logo to brand your own products, in advertising, or in any way that suggests our endorsement without our written permission.

About N-Acetyl-L-valine

N-Acetyl-L-valine is a chemical compound registered under number CAS 96-81-1, with the molecular formula C7H13NO3, and a molar mass of 159.18 g/mol.

The molecule contains 24 atoms connected by 23 chemical bonds. The full systematic IUPAC name of this compound is (2S)-2-acetamido-3-methylbutanoic acid. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 0 (negative value, a hydrophilic compound), polar surface area PSA = 66.4 Ų, 2 donors and 3 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Physicochemical properties
Molecular formulaC7H13NO3
Molar mass159.18 g/mol
IUPAC(2S)-2-acetamido-3-methylbutanoic acid
SMILESCC(C)[C@@H](C(=O)O)NC(=O)C
InChIKeyIHYJTAOFMMMOPX-LURJTMIESA-N
logP (XLogP3)0
PSA66.4 Ų
HBD / HBA2 / 3
PubChem CIDCID 66789 ↗
Scientific literature

Brak articles naukowych dla CAS 96-81-1 w PubMed / OpenAlex / Semantic Scholar.

Synonyms
N-Acetyl-L-valine · 96-81-1 · Ac-Val-OH · Acetyl-L-Valine · Acetylvaline · L-Valine, N-acetyl- · (2S)-2-acetamido-3-methylbutanoic acid · (S)-2-Acetamido-3-methylbutanoic acid · Valine, N-acetyl- · MFCD00066066 · N-Acetyl Valine · Valine, N-acetyl-, L- · Ac-L-Val-OH · n-acetyl-Valine · AC-VAL
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
N-Acetyl-L-valine · 96-81-1
InChIKey
IHYJTAOFMMMOPX-LURJTMIESA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — N-Acetyl-L-valine (CAS 96-81-1)
License & provenance record
N-Acetyl-L-valine (CAS 96-81-1) →
MolGod molecule record
N-Acetyl-L-valine →
Source data
PubChem CID 66789 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
4f16bd05297470a43580d994491ce9ce9d614663ab21b99b516e647a645ab197
MD5 (STL)
58290c53b2bbee80cbbf0b9984079e0a
MolGod Identification Number
MG_629-468-302-19
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
not published yet
Free printable molecule model
Download the model, print it and use it in education. When you publish a photo, a material or an adaptation, the CC BY-SA 4.0 International licence requires you to credit “MolGod Scientific” as the author of the model, link to the original and to the licence text, indicate any changes you made and share adaptations under the same licence. A ready-to-use attribution text is in this section. No sign-up, no fees and no obligation to leave a review.

This license applies to the MolGod-created STL mesh, not automatically to third-party source material.

—