| CAS Number | 173163-13-8 |
| Catalog Number | AG00AD9J(AGN-PC-0NF4YG) |
| Chemical Name | [4-[2-(DiMethylaMino)ethoxy]phenyl](4-hydroxyphenyl)Methanone |
| IUPAC Name | [4-[2-(dimethylamino)ethoxy]phenyl]-(4-hydroxyphenyl)methanone |
| InChI | InChI=1S/C17H19NO3/c1-18(2)11-12-21-16-9-5-14(6-10-16)17(20)13-3-7-15(19)8-4-13/h3-10,19H,11-12H2,1-2H3 |
| InChI Key | VBBSPGVSLKBZRW-UHFFFAOYSA-N |
| MDL Number | MFCD30186989 |
| Molecular Formula | C17H19NO3 |
| Molecular Weight | 285.3377 |
| SMILES | CN(C)CCOC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)O |
| Synonyms | 173163-13-8,
(4-(2-(Dimethylamino)ethoxy)phenyl)(4-hydroxyphenyl)methanone,
[4-[2-(Dimethylamino)ethoxy]phenyl](4-hydroxyphenyl)methanone,
SCHEMBL4729221,
[4-[2-(dimethylamino)ethoxy]phenyl]-(4-hydroxyphenyl)methanone,
VBBSPGVSLKBZRW-UHFFFAOYSA-N,
CID11055237,
[4-(2-dimethylaminoethoxy)phenyl]-(4-hydroxyphenyl)methanone,
|
| Complexity | 316 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 285.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 285.343g/mol |
| Monoisotopic Mass | 285.136g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
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Certificate of Analysis
Lot Number