| CAS Number | 1075748-44-5 |
| Catalog Number | AG01A53C |
| Chemical Name | 3,5-Dimethoxybenzene-1,2-diamine |
| IUPAC Name | 3,5-dimethoxybenzene-1,2-diamine |
| InChI | InChI=1S/C8H12N2O2/c1-11-5-3-6(9)8(10)7(4-5)12-2/h3-4H,9-10H2,1-2H3 |
| InChI Key | ZFAAJSYHBXBLJP-UHFFFAOYSA-N |
| MDL Number | MFCD20702380 |
| Molecular Formula | C8H12N2O2 |
| Molecular Weight | 168.1931 |
| SMILES | COC1=C(C(=CC(=C1)OC)N)N |
| Synonyms | 3,5-dimethoxybenzene-1,2-diamine,
1075748-44-5,
SCHEMBL2841590,
ZFAAJSYHBXBLJP-UHFFFAOYSA-N,
3,5-Dimethoxy-benzene-1,2-diamine,
ZINC95220998,
AKOS033599080,
MCULE-5550268609,
NE25752,
Z1820079217,
3,5-dimethoxy-1,2-benzenediamine,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.196g/mol |
| Monoisotopic Mass | 168.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 70.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number