| CAS Number | 140836-70-0 |
| Catalog Number | AG00A2G1(AGN-PC-015RY0) |
| Chemical Name | {3-[2-(dimethylamino)ethoxy]phenyl}methanamine |
| IUPAC Name | 2-[3-(aminomethyl)phenoxy]-N,N-dimethylethanamine |
| InChI | InChI=1S/C11H18N2O/c1-13(2)6-7-14-11-5-3-4-10(8-11)9-12/h3-5,8H,6-7,9,12H2,1-2H3 |
| InChI Key | CJJHPYWTHROFEE-UHFFFAOYSA-N |
| MDL Number | MFCD09043583 |
| Molecular Formula | C11H18N2O |
| Molecular Weight | 194.2734 |
| SMILES | CN(CCOC1=CC(CN)=CC=C1)C |
| Synonyms | {3-[2-(dimethylamino)ethoxy]phenyl}methanamine,
[2-(3-Aminomethyl-phenoxy)-ethyl]-dimethyl-amine,
140836-70-0,
AC1Q3WWP,
2-[3-(Aminomethyl)phenoxy]-N,N-dimethylethanamine,
SCHEMBL781665,
CTK7E5805,
CJJHPYWTHROFEE-UHFFFAOYSA-N,
4192AD,
SBB085456,
ZINC11956737,
AKOS000127388,
MCULE-1849974835,
NE14150,
TR-056648,
2(3-Aminomethyl-phenoxy)-ethyl-dimethyl-amine,
EN300-43453,
{2-[3-(aminomethyl)phenoxy]ethyl}dimethylamine,
C11H18N2O,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.278g/mol |
| Monoisotopic Mass | 194.142g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number