2-((5,6,7,8-Tetrahydronaphthalen-2-yl)oxy)butanoic acid
Basic information
- CAS
869947-98-8- Standard SMILES
CCC(Oc1ccc2c(c1)CCCC2)C(=O)O- InChIKey
YMERGXVWLWRYGI-UHFFFAOYSA-N- Molecular formula
- C14H18O3
- Average molar mass
- 234.29 g/mol
- Monoisotopic mass
- 234.12559443
Names & identifiers
- Preferred name
- 2-((5,6,7,8-Tetrahydronaphthalen-2-yl)oxy)butanoic acid
- IUPAC
- 2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butanoic acid
- English name
- CHEMBRDG-BB 9070900
- Molecular formula
- C14H18O3
- Molecular weight
- 234.29
Names & synonyms
869947-98-82-(5,6,7,8-TETRAHYDRO-2-NAPHTHALENYLOXY)BUTANOIC ACID2-((5,6,7,8-Tetrahydronaphthalen-2-yl)oxy)butanoic acid2-(5,6,7,8-TETRAHYDRONAPHTHALEN-2-YLOXY)BUTANOIC ACID2-[(5,6,7,8-Tetrahydronaphthalen-2-yl)oxy]butanoic acid2-tetralin-6-yloxybutanoic acidDTXSID40672528MFCD08691908STL194251AKOS010658805BS-360912-((5,6,7,8-Tetrahydronaphthalen-2-yl)oxy)butanoicacid
Show more names
CHEMBRDG-BB 9070900Butanoic acid, 2-[(5,6,7,8-tetrahydro-2-naphthalenyl)oxy]-2-(5,6,7,8-tetrahydro-2-naphthalenyloxy)butanoic acid(SALTDATA: FREE)
Database identifiers
- CAS
869947-98-8- PubChem CID
- 45791306
- DTXSID
DTXSID40672528
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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