| CAS Number | 106797-69-7 |
| Catalog Number | AG007TVQ(AGN-PC-00FX98) |
| Chemical Name | 3-(3-Phenoxyphenyl)propan-1-ol |
| IUPAC Name | 3-(3-phenoxyphenyl)propan-1-ol |
| InChI | InChI=1S/C15H16O2/c16-11-5-7-13-6-4-10-15(12-13)17-14-8-2-1-3-9-14/h1-4,6,8-10,12,16H,5,7,11H2 |
| InChI Key | KAZMRBRDDGQJGV-UHFFFAOYSA-N |
| MDL Number | MFCD09028720 |
| Molecular Formula | C15H16O2 |
| Molecular Weight | 228.2863 |
| SMILES | OCCCc1cccc(Oc2ccccc2)c1 |
| Synonyms | 3-(3-phenoxyphenyl)propan-1-ol,
106797-69-7,
Benzenepropanol,3-phenoxy-,
ACMC-20mala,
3-(3-phenoxyphenyl)propanol,
SCHEMBL7774935,
CTK4A4776,
DTXSID90472358,
KAZMRBRDDGQJGV-UHFFFAOYSA-N,
MFCD09028720,
ZINC36427054,
AKOS022396630,
KS-000019N1,
3-(3-PHENOXY-PHENYL)-PROPAN-1-OL,
CS-0036778,
3-Phenoxy-benzenepropanol,
CID11775947,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.291g/mol |
| Monoisotopic Mass | 228.115g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
|
Certificate of Analysis
Lot Number