Benzoic acid, 5-hexadecyl-2-hydroxy-
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Basic information
- CAS
28294-58-8- Standard SMILES
CCCCCCCCCCCCCCCCc1ccc(O)c(C(=O)O)c1- InChIKey
VCLDAIPENLEIRV-UHFFFAOYSA-N- Molecular formula
- C23H38O3
- Average molar mass
- 362.5 g/mol
- Monoisotopic mass
- 362.28209507
Names & identifiers
- Preferred name
- Benzoic acid, 5-hexadecyl-2-hydroxy-
- IUPAC
- 5-hexadecyl-2-hydroxybenzoic acid
- English name
- 5-hexadecylsalicylic acid
- Molecular formula
- C23H38O3
- Molecular weight
- 362.54602
Names & synonyms
28294-58-8Benzoic acid, 5-hexadecyl-2-hydroxy-EINECS 248-944-4DTXSID2067375RefChem:566124DTXCID40377945-Hexadecylsalicylic acid5-hexadecyl-2-hydroxybenzoic acidSCHEMBL32200255-(hexadec-1-yl)salicylic acidNS00028454
Database identifiers
- CAS
28294-58-8- PubChem CID
- 110437
- DTXSID
DTXSID2067375- EC Number
- 248-944-4
- Nikkaji
- J250.692K
Properties
Computed structural propertiesFilling in
- XLogP
- 10.8
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 16
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 342
Physicochemical properties
- EPA Substance Registry System
- 5 · Benzoic acid, 5-hexadecyl-2-hydroxy- (28294-58-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzoic acid, 5-hexadecyl-2-hydroxy-: INACTIVE
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Related reactions
1 records
Compound notes
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