| CAS Number | 459-20-1 |
| Catalog Number | AG00D957(AGN-PC-0RU6GL) |
| Chemical Name | 4-Fluoro-N-methylbenzylamine hydrochloride |
| IUPAC Name | 1-(4-fluorophenyl)-N-methylmethanamine;hydrochloride |
| InChI | InChI=1S/C8H10FN.ClH/c1-10-6-7-2-4-8(9)5-3-7;/h2-5,10H,6H2,1H3;1H |
| InChI Key | COVGVSDDHGBOBV-UHFFFAOYSA-N |
| MDL Number | MFCD07106763 |
| Molecular Formula | C8H11ClFN |
| Molecular Weight | 175.6310 |
| SMILES | Cl.CNCC1=CC=C(F)C=C1 |
| Synonyms | 459-20-1,
(4-Fluoro-benzyl)-methylamine HCl,
4-Fluoro-N-methylbenzylamine hydrochloride,
(4-Fluoro-benzyl)-methyl-amine hydrochloride,
EN300-40212,
N-(4-fluorobenzyl)-N-methylamine hydrochloride,
[(4-fluorophenyl)methyl](methyl)amine hydrochloride,
1-(4-Fluorophenyl)-N-methylmethanamine hydrochloride,
AC1Q3BT1,
SCHEMBL6252163,
CTK8F1830,
DTXSID30506984,
ACM459201,
MFCD07106763,
NE62380,
AS-30763,
(4-Fluoro-benzyl)-methylamine hydrochloride,
1-(4-Fluorophenyl)-N-methylmethanamine--hydrogen chloride (1/1),
1-(4-fluorophenyl)-N-methylmethanamine,hydrochloride,
|
| Complexity | 87.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.631g/mol |
| Monoisotopic Mass | 175.056g/mol |
| Rotatable Bond Count | 2 |
| 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
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