| CAS Number | 952285-55-1 |
| Catalog Number | AG01A2U4 |
| Chemical Name | Methyl 4-hydrazinyl-3-methoxybenzoate |
| IUPAC Name | methyl 4-hydrazinyl-3-methoxybenzoate |
| InChI | InChI=1S/C9H12N2O3/c1-13-8-5-6(9(12)14-2)3-4-7(8)11-10/h3-5,11H,10H2,1-2H3 |
| InChI Key | KLRXHYADHYXIAA-UHFFFAOYSA-N |
| MDL Number | MFCD19201437 |
| Molecular Formula | C9H12N2O3 |
| Molecular Weight | 196.2032 |
| SMILES | COC(C1=CC(OC)=C(NN)C=C1)=O |
| Synonyms | methyl 4-hydrazinyl-3-methoxybenzoate,
952285-55-1,
SCHEMBL761046,
Benzoic acid, 4-hydrazinyl-3-methoxy-, methyl ester,
KLRXHYADHYXIAA-UHFFFAOYSA-N,
methyl 4-hydrazino-3-methoxybenzoate,
MFCD19201437,
ZINC88611546,
AKOS006334073,
NE47116,
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| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.206g/mol |
| Monoisotopic Mass | 196.085g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 73.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number