| CAS Number | 1158263-30-9 |
| Catalog Number | AG000GXB(AGN-PC-01EMZ2) |
| Chemical Name | N-(4-Chlorobenzyl)cyclopropanamine hydrochloride |
| IUPAC Name | N-[(4-chlorophenyl)methyl]cyclopropanamine;hydrochloride |
| InChI | InChI=1S/C10H12ClN.ClH/c11-9-3-1-8(2-4-9)7-12-10-5-6-10;/h1-4,10,12H,5-7H2;1H |
| InChI Key | QTHQCXWGMLXJIO-UHFFFAOYSA-N |
| MDL Number | MFCD07110804 |
| Molecular Formula | C10H13Cl2N |
| Molecular Weight | 218.1229 |
| SMILES | ClC1=CC=C(C=C1)CNC2CC2.[H]Cl |
| Synonyms | N-(4-Chlorobenzyl)cyclopropanamine hydrochloride,
1158263-30-9,
(4-Chloro-benzyl)-cyclopropyl-amine hydrochloride,
ZX-CM018143,
MFCD07110804,
AKOS024464258,
AM90767,
MCULE-3291815559,
AK160426,
AX8293564,
ST24048390,
(4-chlorobenzyl)cyclopropylamine hydrochloride,
Benzenemethanamine, 4-chloro-N-cyclopropyl-, hydrochloride (1:1),
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| Complexity | 137 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.121g/mol |
| Monoisotopic Mass | 217.043g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 12A^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