| CAS Number | 903581-03-3 |
| Catalog Number | AG00GSO7 |
| Chemical Name | 1-(5-Chloro-2,3-dimethoxyphenyl)ethylamine |
| IUPAC Name | 1-(5-chloro-2,3-dimethoxyphenyl)ethanamine |
| InChI | InChI=1S/C10H14ClNO2/c1-6(12)8-4-7(11)5-9(13-2)10(8)14-3/h4-6H,12H2,1-3H3 |
| InChI Key | ZOKMGLLBAVJILD-UHFFFAOYSA-N |
| MDL Number | MFCD09800421 |
| Molecular Formula | C10H14ClNO2 |
| Molecular Weight | 215.6767 |
| SMILES | COC1=C(OC)C(C(N)C)=CC(Cl)=C1 |
| Synonyms | 1-(5-Chloro-2,3-dimethoxyphenyl)ethylamine,
903581-03-3,
1-(5-Chloro-2,3-dimethoxy-phenyl)-ethylamine,
1-(5-CHLORO-2,3-DIMETHOXYPHENYL)ETHANAMINE,
SCHEMBL1748555,
CTK5G7704,
DTXSID40679451,
ZOKMGLLBAVJILD-UHFFFAOYSA-N,
MFCD09800421,
AS-37235,
RT-006102,
X-2225,
1-(5-chloro-2,3-dimethoxy-phenyl)-ethyl amine,
1-(5-Chloro-2,3-dimethoxyphenyl)ethan-1-amine,
1- ETHYLAMINE,
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| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.677g/mol |
| Monoisotopic Mass | 215.071g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number