Benzoic acid, 2-hydroxy-5-(1-methyl-1-phenylethyl)-
Basic information
- CAS
54301-66-5- Standard SMILES
CC(C)(c1ccccc1)c1ccc(O)c(C(=O)O)c1- InChIKey
PSDGDNGXVIPBLE-UHFFFAOYSA-N- Molecular formula
- C16H16O3
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.10994437
Names & identifiers
- Preferred name
- Benzoic acid, 2-hydroxy-5-(1-methyl-1-phenylethyl)-
- IUPAC
- 2-hydroxy-5-(2-phenylpropan-2-yl)benzoic acid
Names & synonyms
Benzoic acid, 2-hydroxy-5-(1-methyl-1-phenylethyl)-54301-66-5DTXSID30351714RefChem:326899DTXCID703027802-hydroxy-5-(2-phenylpropan-2-yl)benzoic acid2-hydroxy-5-(1-methyl-1-phenylethyl)benzoic acidSCHEMBL5442998STK679697AKOS005595762ST4076769ST45336869
Show more names
5-(alpha, alpha-dimethylbenzyl)salicylic acidAE-641/00008001
Database identifiers
- CAS
54301-66-5- PubChem CID
- 707669
- DTXSID
DTXSID30351714- Nikkaji
- J2.299.338K
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 318
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
1 records
Compound notes
Loading…