| CAS Number | 886457-43-8 |
| Catalog Number | AG00IFAD(AGN-PC-0VMVNU) |
| Chemical Name | [4-(Pyrrol-1-YL)phenyl]methanamine hcl |
| IUPAC Name | (4-pyrrol-1-ylphenyl)methanamine;hydrochloride |
| InChI | InChI=1S/C11H12N2.ClH/c12-9-10-3-5-11(6-4-10)13-7-1-2-8-13;/h1-8H,9,12H2;1H |
| InChI Key | FINGFRBGAKNYGM-UHFFFAOYSA-N |
| MDL Number | MFCD22574945 |
| Molecular Formula | C11H13ClN2 |
| Molecular Weight | 208.6873 |
| SMILES | NCc1ccc(cc1)n1cccc1.Cl |
| Synonyms | [4-(PYRROL-1-YL)PHENYL]METHANAMINE HCL,
886457-43-8,
KM2695,
AKOS024397069,
MCULE-1822395748,
V8678,
Benzenemethanamine, 4-(1H-pyrrol-1-yl)-, monohydrochloride,
C11H12N2.HCl,
|
| Complexity | 144 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.689g/mol |
| Monoisotopic Mass | 208.077g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 31A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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