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4-Carbamoylphenyl ethyl ethylphosphonate

HCID 3057421
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Basic information

CAS
74038-41-8
Standard SMILES
CCOP(=O)(CC)Oc1ccc(C(N)=O)cc1
InChIKey
UBNXGZRGACOTNW-UHFFFAOYSA-N
Molecular formula
C11H16NO4P
Average molar mass
257.22 g/mol
Monoisotopic mass
257.08169499

Names & identifiers

Preferred name
4-Carbamoylphenyl ethyl ethylphosphonate
IUPAC
4-[ethoxy(ethyl)phosphoryl]oxybenzamide
English name
Ethylphosphonic acid 4-(aminocarbonyl)phenylethyl ester
Molecular weight
0

Names & synonyms

74038-41-84-Carbamoylphenyl ethyl ethylphosphonateDTXSID90995395RefChem:1070458DTXCID901422422Chemagro S-9230Ethyl ethylphosphonate ester with p-hydroxybenzamidePhosphonic acid, ethyl-, ethyl ester, ester with p-hydroxybenzamideEthylphosphonic acid 4-(aminocarbonyl)phenylethyl ester

Database identifiers

CAS
74038-41-8
PubChem CID
3057421
DTXSID
DTXSID90995395
Nikkaji
J92.071A

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
78.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
17
Formal charge
0
Complexity
300

Related reactions

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Compound notes

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