CAS 55860-35-0 manufacturers and suppliers on PharmaCompass

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Also known as: 55860-35-0, Schembl2012610, 4-acetyl-2-methyl-benzoic acid, Zinc71611028, Db-087369, Cs-0112809
Molecular Formula
C10H10O3
Molecular Weight
178.18  g/mol
InChI Key
QGXDUDDPMXVLOO-UHFFFAOYSA-N

CAS 55860-35-0
1 2D Structure

CAS 55860-35-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-acetyl-2-methylbenzoic acid
2.1.2 InChI
InChI=1S/C10H10O3/c1-6-5-8(7(2)11)3-4-9(6)10(12)13/h3-5H,1-2H3,(H,12,13)
2.1.3 InChI Key
QGXDUDDPMXVLOO-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C(C=CC(=C1)C(=O)C)C(=O)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 55860-35-0

2. Schembl2012610

3. 4-acetyl-2-methyl-benzoic Acid

4. Zinc71611028

5. Db-087369

6. Cs-0112809

7. F53493

8. A1-08799

2.3 Create Date
2011-10-30
3 Chemical and Physical Properties
Molecular Weight 178.18 g/mol
Molecular Formula C10H10O3
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass178.062994177 g/mol
Monoisotopic Mass178.062994177 g/mol
Topological Polar Surface Area54.4 Ų
Heavy Atom Count13
Formal Charge0
Complexity222
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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SUPPLIERS

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01

  • fda
  • EDQM
  • WHO-GMP

Virtual BoothChina's leading API and intermediate manufacturer, offering CMO/CDMO services and exports to 70+ countries, enhancing global health.

4-acetyl-2-methylbenzoic acid

CAS Number : 55860-35-0

End Use API :

About the Company : Shandong Chenghui Shuangda Pharmaceutical Co., Ltd. is specialized in R&D and production of APIs and advanced intermediates. With 22 years of production experience,the company has 6 wor...

Shandong Chenghui Shuangda Pharmaceutical

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Natural Products Expo
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Aventus Labs

India
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4-Acetyl-2-methylbenzoic acid

CAS Number : 55860-35-0

End Use API :

About the Company : Aventus Labs is a forward-thinking pharmaceutical company committed to developing and delivering high-quality, effective healthcare solutions. With a focus on rigorous research and adhe...

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Natural Products Expo
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LinkChem

China
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Natural Products Expo
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4-acetyl-2-methylbenzoic acid

CAS Number : 55860-35-0

End Use API :

About the Company : LinkChem is a leading China headquartered CMO | CRO provider within the pharmaceutical industry. Our core focus includes: custom synthesis, process development, and manufacturing of key...

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