Compound Summary


valproic acid
  Compound Information
 VALPROIC ACID

Compound Name:

VALPROIC ACID

Compound CID:

3121

Synonyms:

VALPROIC ACID

2-Propylpentanoic acid

99-66-1

2-Propylvaleric acid

Dipropylacetic acid

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Iupac Name:

2-propylpentanoic acid

InChI:

InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)

InChIKey:

NIJJYAXOARWZEE-UHFFFAOYSA-N

Canonical Smiles:

CCCC(CCC)C(=O)O

Isomeric Smiles:

CCCC(CCC)C(=O)O

Molecular Weight:

144.21

Molecular Formula:

C8H16O2

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 VALPROIC ACID

Molecular Weight:

144.21

Molecular Formula:

C8H16O2

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

2

Rotatable Bond Count:

5

Heavy Atom Count:

10

Complexity:

93.4

  Synonyms
 VALPROIC ACID

  Experimental Data
 VALPROIC ACID

  Experimental Data Visualization
 VALPROIC ACID

  Statistics Data
 VALPROIC ACID

  Statistics Data Visualization
 VALPROIC ACID