| CAS Number | 1049030-20-7 |
| Catalog Number | AG01ACD8(AGN-PC-0WP072) |
| Chemical Name | [2-(Propan-2-yloxy)naphthalen-1-yl]methanamine |
| IUPAC Name | (2-propan-2-yloxynaphthalen-1-yl)methanamine |
| InChI | InChI=1S/C14H17NO/c1-10(2)16-14-8-7-11-5-3-4-6-12(11)13(14)9-15/h3-8,10H,9,15H2,1-2H3 |
| InChI Key | SFSIQOGCFKWXBV-UHFFFAOYSA-N |
| MDL Number | MFCD11501614 |
| Molecular Formula | C14H17NO |
| Molecular Weight | 215.2909 |
| SMILES | CC(OC1=C(CN)C2=C(C=CC=C2)C=C1)C |
| Synonyms | 1049030-20-7,
(2-isopropoxynaphthalen-1-yl)methanamine,
[2-(propan-2-yloxy)naphthalen-1-yl]methanamine,
[2-(methylethoxy)naphthyl]methylamine,
1-[2-(propan-2-yloxy)naphthalen-1-yl]methanamine,
BBL031912,
SBB045918,
STK802381,
ZINC19702698,
AKOS000271904,
MCULE-5082176219,
NE27831,
ST50807886,
A1-12035,
(2-propan-2-yloxynaphthalen-1-yl)methanamine,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.296g/mol |
| Monoisotopic Mass | 215.131g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number