| CAS Number | 1447607-36-4 |
| Catalog Number | AG00AS0F(AGN-PC-0JK1YG) |
| Chemical Name | TERT-BUTYL 7-FLUOROQUINOLIN-4-YLCARBAMATE |
| IUPAC Name | tert-butyl N-(7-fluoroquinolin-4-yl)carbamate |
| InChI | InChI=1S/C14H15FN2O2/c1-14(2,3)19-13(18)17-11-6-7-16-12-8-9(15)4-5-10(11)12/h4-8H,1-3H3,(H,16,17,18) |
| InChI Key | TZGZDBZYNMFJIB-UHFFFAOYSA-N |
| MDL Number | MFCD25542349 |
| Molecular Formula | C14H15FN2O2 |
| Molecular Weight | 262.2795 |
| SMILES | O=C(OC(C)(C)C)NC1=CC=NC2=CC(F)=CC=C12 |
| Synonyms | 1447607-36-4,
TERT-BUTYL 7-FLUOROQUINOLIN-4-YLCARBAMATE,
tert-Butyl (7-fluoroquinolin-4-yl)carbamate,
MFCD25542349,
ZINC95802879,
AKOS025146653,
FCH3086431,
AK164606,
AS-41953,
SC-68447,
tert-butyl N-(7-fluoroquinolin-4-yl)carbamate,
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| Complexity | 330 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.112g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 262.284g/mol |
| Monoisotopic Mass | 262.112g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number