2-Propanol, 1,3-bis(4-nonylphenoxy)-
Basic information
- CAS
14569-71-2- Standard SMILES
CCCCCCCCCc1ccc(OCC(O)COc2ccc(CCCCCCCCC)cc2)cc1- InChIKey
GZHMCMAVIFKXEJ-UHFFFAOYSA-N- Molecular formula
- C33H52O3
- Average molar mass
- 496.8 g/mol
- Monoisotopic mass
- 496.39164552
Names & identifiers
- Preferred name
- 2-Propanol, 1,3-bis(4-nonylphenoxy)-
- IUPAC
- 1,3-bis(4-nonylphenoxy)propan-2-ol
- English name
- 1,3-Bis(4-nonylphenoxy)-2-propanol
- Molecular formula
- C33H52O3
- Molecular weight
- 496.76
Names & synonyms
1,3-Bis(4-nonylphenoxy)-2-propanol2-Propanol, 1,3-bis(4-nonylphenoxy)-DTXSID4065787RefChem:89153DTXCID90347391,3-bis(4-nonylphenoxy)propan-2-ol14569-71-2GZHMCMAVIFKXEJ-UHFFFAOYSA-N
Database identifiers
- CAS
14569-71-2- PubChem CID
- 84529
- DTXSID
DTXSID4065787- Nikkaji
- J241.454F
Properties
Computed structural properties
- XLogP
- 12.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 22
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 424
Physicochemical properties
- EPA Substance Registry System
- 2 · 2-Propanol, 1,3-bis(4-nonylphenoxy)- (14569-71-2)
- 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 Information2-Propanol, 1,3-bis(4-nonylphenoxy)-: INACTIVE
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Related reactions
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Compound notes
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