| CAS Number | 1156296-61-5 |
| Catalog Number | AG01ADVM(AGN-PC-0WOAE9) |
| Chemical Name | 3-(3-chlorophenyl)cyclobutan-1-amine |
| IUPAC Name | 3-(3-chlorophenyl)cyclobutan-1-amine |
| InChI | InChI=1S/C10H12ClN/c11-9-3-1-2-7(4-9)8-5-10(12)6-8/h1-4,8,10H,5-6,12H2 |
| InChI Key | CJAGMOBAPVWUER-UHFFFAOYSA-N |
| MDL Number | MFCD12097694 |
| Molecular Formula | C10H12ClN |
| Molecular Weight | 181.6620 |
| SMILES | NC1CC(C2=CC(Cl)=CC=C2)C1 |
| Synonyms | 3-(3-chlorophenyl)cyclobutan-1-amine,
1156296-61-5,
ZINC36840695,
AKOS009826398,
AKOS026741388,
ZINC216657466,
ZINC238850655,
MCULE-2821067335,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.663g/mol |
| Monoisotopic Mass | 181.066g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number