| CAS Number | 5267-37-8 |
| Catalog Number | AG00DLJA(AGN-PC-03CFL1) |
| Chemical Name | C-(3-CHLORO-PHENYL)-C-PHENYL-METHYLAMINE HYDROCHLORIDE |
| IUPAC Name | (3-chlorophenyl)-phenylmethanamine;hydrochloride |
| InChI | InChI=1S/C13H12ClN.ClH/c14-12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10;/h1-9,13H,15H2;1H |
| InChI Key | UCOACANPNQMECK-UHFFFAOYSA-N |
| MDL Number | MFCD08544210 |
| Molecular Formula | C13H13Cl2N |
| Molecular Weight | 254.1550 |
| SMILES | NC(C1=CC=CC=C1)C2=CC=CC(Cl)=C2.[H]Cl |
| Synonyms | (3-chlorophenyl)(phenyl)methanamine hydrochloride,
5267-37-8,
C-(3-Chloro-phenyl)-C-phenyl-methylamine hydrochloride,
AC1Q3CTY,
SCHEMBL7102269,
CTK8E0946,
DTXSID00615613,
AKOS030691033,
MCULE-2096918934,
NE21172,
EN300-43197,
Z444311414,
1-(3-Chlorophenyl)-1-phenylmethanamine--hydrogen chloride (1/1),
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| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.154g/mol |
| Monoisotopic Mass | 253.043g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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