Structure Database (LMSD)

Common Name
5-chloropentanoic acid
Systematic Name
5-chloropentanoic acid
Synonyms
  • 5-chloro-n-valeric acid
  • 5-chloro-pentanoic acid
  • 5-chloro-valeric acid
  • 5-chlorovaleric acid
  • omega-chloropentanoic acid
  • omega-chlorovaleric acid
LM ID
LMFA01090154
Formula
C5H9O2Cl
Exact Mass
Calculate m/z
136.029108
Status
Curated

Classification

String Representations

InChiKey (Click to copy)
YSXDKDWNIPOSMF-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C5H9ClO2/c6-4-2-1-3-5(7)8/h1-4H2,(H,7,8)
SMILES (Click to copy)
C(=O)(O)CCCCCl

Other Databases

CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 8
Rings 0
Aromatic Rings 0
Rotatable Bonds 4
Van der Waals Molecular Volume 125.21
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 1.76
Molar Refractivity 32.70

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Updated at
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