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4-Chloro-N-hexadecyl-1-hydroxynaphthalene-2-carboxamide

HCID 3086010
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Basic information

CAS
74918-83-5
Standard SMILES
CCCCCCCCCCCCCCCCNC(=O)c1cc(Cl)c2ccccc2c1O
InChIKey
BXJYXMAJSAZMOY-UHFFFAOYSA-N
Molecular formula
C27H40ClNO2
Average molar mass
446.1 g/mol
Monoisotopic mass
445.2747572

Names & identifiers

Preferred name
4-Chloro-N-hexadecyl-1-hydroxynaphthalene-2-carboxamide
IUPAC
4-chloro-N-hexadecyl-1-hydroxynaphthalene-2-carboxamide
English name
4-chloro-N-hexadecyl-1-hydroxynaphthalene-2-carboxamide
Molecular formula
C27H40ClNO2
Molecular weight
446.065

Names & synonyms

4-Chloro-N-hexadecyl-1-hydroxynaphthalene-2-carboxamide74918-83-5EINECS 278-023-22-Naphthalenecarboxamide, 4-chloro-N-hexadecyl-1-hydroxy-T2T4N8T6L7SCHEMBL11316839DTXSID60225893NS000376654-Chloro-N-hexadecyl-1-hydroxy-2-naphthalenecarboxamide1-Hydroxy-4-chloro-N-hexadecyl-2-naphthamide2-Naphthalenecarboxamide,4-chloro-N-hexadecyl-1-hydroxy-

Database identifiers

CAS
74918-83-5
PubChem CID
3086010
DTXSID
DTXSID60225893
UNII
T2T4N8T6L7
EC Number
278-023-2
Nikkaji
J170.875I

Properties

Computed structural properties

XLogP
11
Topological polar surface area
49.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
16
Heavy atoms
31
Formal charge
0
Complexity
472

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Compound notes

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