| CAS Number | 915402-09-4 |
| Catalog Number | AG00GUYY(AGN-PC-0WA36N) |
| Chemical Name | [1-(3-Bromophenyl)cyclobutyl]methanamine HCl |
| IUPAC Name | [1-(3-bromophenyl)cyclobutyl]methanamine;hydrochloride |
| InChI | InChI=1S/C11H14BrN.ClH/c12-10-4-1-3-9(7-10)11(8-13)5-2-6-11;/h1,3-4,7H,2,5-6,8,13H2;1H |
| InChI Key | NFESFSWWFWELGV-UHFFFAOYSA-N |
| MDL Number | MFCD08706301 |
| Molecular Formula | C11H15BrClN |
| Molecular Weight | 276.6005 |
| SMILES | Cl.NCC1(CCC1)C1=CC=CC(Br)=C1 |
| Synonyms | 915402-09-4,
(1-(3-bromophenyl)cyclobutyl)methanamine hydrochloride,
[1-(3-Bromophenyl)cyclobutyl]methanamine HCl,
(1-(3-bromophenyl)cyclobutyl)methanamine HCl,
1-(3-bromophenyl)Cyclobutanemethanamine hydrochloride,
CTK8C6549,
DTXSID20592230,
KM3027,
MFCD08706301,
AKOS015847493,
AS-39961,
AX8281617,
DB-079063,
TC-062810,
FT-0743698,
V9097,
1-[1-(3-Bromophenyl)cyclobutyl]methanamine--hydrogen chloride (1/1),
C11H14BrN.HCl,
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| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.008g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 276.602g/mol |
| Monoisotopic Mass | 275.008g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number