| CAS Number | 91896-84-3 |
| Catalog Number | AG01A7X0(AGN-PC-0VX2WI) |
| Chemical Name | 2-(3,4-Dichlorophenyl)propan-2-amine |
| IUPAC Name | 2-(3,4-dichlorophenyl)propan-2-amine |
| InChI | InChI=1S/C9H11Cl2N/c1-9(2,12)6-3-4-7(10)8(11)5-6/h3-5H,12H2,1-2H3 |
| InChI Key | HPPKUNCSPAIKBD-UHFFFAOYSA-N |
| MDL Number | MFCD11581296 |
| Molecular Formula | C9H11Cl2N |
| Molecular Weight | 204.0963 |
| SMILES | CC(C1=CC(Cl)=C(Cl)C=C1)(N)C |
| Synonyms | 2-(3,4-dichlorophenyl)propan-2-amine,
91896-84-3,
AC1Q1NMC,
SCHEMBL2796185,
CTK6H1096,
ZINC19673407,
AKOS010213488,
MCULE-2048660326,
NE36779,
EN300-60050,
Z1262252991,
|
| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.027g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.094g/mol |
| Monoisotopic Mass | 203.027g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
Lot Number