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Phosphoric acid, diethyl 1-naphthalenyl ester

HCID 97573
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
33650-14-5
Standard SMILES
CCOP(=O)(OCC)Oc1cccc2ccccc12
InChIKey
GTLTVBNVOHZJHA-UHFFFAOYSA-N
Molecular formula
C14H17O4P
Average molar mass
280.26 g/mol
Monoisotopic mass
280.08644602

Names & identifiers

Preferred name
Phosphoric acid, diethyl 1-naphthalenyl ester
IUPAC
diethyl naphthalen-1-yl phosphate

Names & synonyms

33650-14-5Phosphoric acid, diethyl 1-naphthalenyl esterdiethyl 1-naphthyl phosphate1-Naphthyl diethyl phosphateYQA5C8ES2VDiethyl 1-naphthalenyl phosphateNSC 133037NSC-133037DTXSID90187334RefChem:173720DTXCID00109825CHEMBL4646822
Show more names
diethyl naphthalen-1-yl phosphateUNII-YQA5C8ES2VSCHEMBL10631805BDBM50543812NSC133037PD169686phosphoric acid diethyl naphthalen-1-yl ester

Database identifiers

CAS
33650-14-5
PubChem CID
97573
DTXSID
DTXSID90187334
ChEMBL
CHEMBL4646822
UNII
YQA5C8ES2V
Nikkaji
J370.959K

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
19
Formal charge
0
Complexity
311

Related reactions

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Compound notes

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