| CAS Number | 500221-71-6 |
| Catalog Number | AG00DIRY(AGN-PC-01Z1EP) |
| Chemical Name | N-(3-Fluorobenzyl)cyclohexanamine |
| IUPAC Name | N-[(3-fluorophenyl)methyl]cyclohexanamine |
| InChI | InChI=1S/C13H18FN/c14-12-6-4-5-11(9-12)10-15-13-7-2-1-3-8-13/h4-6,9,13,15H,1-3,7-8,10H2 |
| InChI Key | VZYLCWFYZXAELP-UHFFFAOYSA-N |
| MDL Number | MFCD11138551 |
| Molecular Formula | C13H18FN |
| Molecular Weight | 207.2871 |
| SMILES | FC1=CC(CNC2CCCCC2)=CC=C1 |
| Synonyms | N-(3-Fluorobenzyl)cyclohexanamine,
500221-71-6,
ACMC-209kjo,
SCHEMBL1041164,
N-Cyclohexyl-3-fluorobenzylamine,
CTK8B1757,
DTXSID70595256,
N-(3-Fluorobenzyl)cyclohexylamine,
ANW-30898,
MFCD11138551,
ZINC19878854,
AKOS000222508,
N-Cyclohexyl-3-fluorobenzylaMine, 97%,
AJ-75618,
N-[(3-Fluorophenyl)methyl]cyclohexanamine,
TC-119643,
V6212,
C13H18FN,
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| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.292g/mol |
| Monoisotopic Mass | 207.142g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number