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Phosphonic acid, (2-chloro-4-nitrophenyl)-

HCID 3087484
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Basic information

CAS
114792-24-4
Standard SMILES
O=[N+]([O-])c1ccc(P(=O)(O)O)c(Cl)c1
InChIKey
PCWPSLCPIKEDCV-UHFFFAOYSA-N
Molecular formula
C6H5ClNO5P
Average molar mass
237.53 g/mol
Monoisotopic mass
236.959387

Names & identifiers

Preferred name
Phosphonic acid, (2-chloro-4-nitrophenyl)-
IUPAC
(2-chloro-4-nitrophenyl)phosphonic acid

Names & synonyms

(2-Chloro-4-nitrophenyl)phosphonic acidPhosphonic acid, (2-chloro-4-nitrophenyl)-BRN 3322783114792-24-4DTXSID001508524-16-00-01087 (Beilstein Handbook Reference)RefChem:370445DTXCID3073343SCHEMBL11157371

Database identifiers

CAS
114792-24-4
PubChem CID
3087484
DTXSID
DTXSID00150852

Properties

Computed structural properties

XLogP
0.4
Topological polar surface area
103 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
274

Related reactions

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Compound notes

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