| CAS Number | 6050-80-2 |
| Catalog Number | AG01C45P(AGN-PC-0NJCMP) |
| Chemical Name | 2H,3H-Naphtho[1,2-B]furan-2-one |
| IUPAC Name | 3H-benzo[g][1]benzofuran-2-one |
| InChI | InChI=1S/C12H8O2/c13-11-7-9-6-5-8-3-1-2-4-10(8)12(9)14-11/h1-6H,7H2 |
| InChI Key | YXVNSYLJLOZDBQ-UHFFFAOYSA-N |
| MDL Number | MFCD29763014 |
| Molecular Formula | C12H8O2 |
| Molecular Weight | 184.1907 |
| SMILES | O=C1CC2=CC=C3C=CC=CC3=C2O1 |
| Synonyms | Naphtho[1,2-b]furan-2(3H)-one,
6050-80-2,
2H,3H-NAPHTHO[1,2-B]FURAN-2-ONE,
benzocoumaranone,
CTK1J0130,
DTXSID40501960,
AKOS033883587,
ZINC196631812,
Z2379087731,
3H-benzo[g][1]benzofuran-2-one,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.194g/mol |
| Monoisotopic Mass | 184.052g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
\N
|
|
Hazard statements
|
H315-H319-H335
|
|
Packing Group
|
\N
|
|
Precautionary statements
|
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P313-P337+P313-P362-P403+P233-P405-P501
|
|
UN Code
|
\N
|
Certificate of Analysis
Lot Number