| CAS Number | 1266320-01-7 |
| Catalog Number | AG009Z20 |
| Chemical Name | 6-Amino-3,3-dimethylbenzo[c][1,2]oxaborol-1(3H)-ol |
| IUPAC Name | 1-hydroxy-3,3-dimethyl-2,1-benzoxaborol-6-amine |
| InChI | InChI=1S/C9H12BNO2/c1-9(2)7-4-3-6(11)5-8(7)10(12)13-9/h3-5,12H,11H2,1-2H3 |
| InChI Key | MAOKJYHLICDJNY-UHFFFAOYSA-N |
| MDL Number | MFCD20727311 |
| Molecular Formula | C9H12BNO2 |
| Molecular Weight | 177.0081 |
| SMILES | OB1c2c(C(O1)(C)C)ccc(c2)N |
| Synonyms | 6-amino-3,3-dimethylbenzo[c][1,2]oxaborol-1(3H)-ol,
1266320-01-7,
6Amino-3,3-dimethylbenzo[c][1,2]oxaborol-1(3H)-ol,
SCHEMBL1164580,
MAOKJYHLICDJNY-UHFFFAOYSA-N,
TQ0194,
ZINC200312833,
CS-15965,
DB-102933,
CS-0079998,
6-amino-3,3-dimethyl-3H-benzo[c][1,2]oxaborol-1-ol,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.096109g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.01g/mol |
| Monoisotopic Mass | 177.096109g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 55.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number