| CAS Number | 13437-79-1 |
| Catalog Number | AG009WQL(AGN-PC-0PK9NG) |
| Chemical Name | 1-Phenylethylamine hcl |
| IUPAC Name | 1-phenylethanamine;hydrochloride |
| InChI | InChI=1S/C8H11N.ClH/c1-7(9)8-5-3-2-4-6-8;/h2-7H,9H2,1H3;1H |
| InChI Key | YEHGSOZIZRABBU-UHFFFAOYSA-N |
| MDL Number | MFCD01732454 |
| Molecular Formula | C8H12ClN |
| Molecular Weight | 157.6406 |
| SMILES | Cl.NC(C1(=CC=CC=C1))C |
| Synonyms | 1-PHENYLETHYLAMINE HCL,
13437-79-1,
SCHEMBL241514,
1-phenylethanamine hydrochloride,
1-phenylethylamine hydrochloride,
YEHGSOZIZRABBU-UHFFFAOYSA-N,
MFCD01732454,
AKOS025295546,
AS-20163,
TR-021253,
Z9757,
K-4232,
C8H11N.HCl,
N-methyl-1-phenylmethanamine hydrochloride,
61789-73-9,
|
| Complexity | 74.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.641g/mol |
| Monoisotopic Mass | 157.066g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number