| CAS Number | 64656-40-2 |
| Catalog Number | AG00EM07(AGN-PC-0KOFAP) |
| Chemical Name | 3-[2-(Diproplyamino)ethyl]phenol hydrobromide |
| IUPAC Name | 3-[2-(dipropylamino)ethyl]phenol;hydrobromide |
| InChI | InChI=1S/C14H23NO.BrH/c1-3-9-15(10-4-2)11-8-13-6-5-7-14(16)12-13;/h5-7,12,16H,3-4,8-11H2,1-2H3;1H |
| InChI Key | KUEBTNOIRGMQAG-UHFFFAOYSA-N |
| MDL Number | MFCD01707429 |
| Molecular Formula | C14H24BrNO |
| Molecular Weight | 302.2505 |
| SMILES | CCCN(CCc1cccc(c1)O)CCC.Br |
| Synonyms | Phenol, m-(2-(dipropylamino)ethyl)-, hydrobromide,
3-(2-Dipropylaminoaethyl)phenol hydrobromid [German],
64656-40-2,
m-(2-(Dipropylamino)ethyl)phenol hydrobromide,
3-(2-(dipropylamino)ethyl)phenol hydrobromide,
3-[2-(dipropylamino)ethyl]phenol hydrobromide,
3-(2-Dipropylaminoaethyl)phenol hydrobromid,
79412-65-0,
AC1MIO15,
CHEMBL3247632,
DTXSID20214920,
LS-104590,
3-(2-Dipropylamino-ethyl)-phenol hydrobromide,
3-[2-(Diproplyamino)ethyl]phenol hydrobromide,
C14H23NO.BrH,
C14-H23-N-O.Br-H,
CID3049325,
Phenol hydrobromide, 3-[2-(Diproplyamino)ethyl],
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 301.104g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 302.256g/mol |
| Monoisotopic Mass | 301.104g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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