| CAS Number | 380378-92-7 |
| Catalog Number | AG00I7HB(AGN-PC-0NAQ80) |
| Chemical Name | 6-Chloro-2-N-ethylpyridine-2,3-diamine |
| IUPAC Name | 6-chloro-2-N-ethylpyridine-2,3-diamine |
| InChI | InChI=1S/C7H10ClN3/c1-2-10-7-5(9)3-4-6(8)11-7/h3-4H,2,9H2,1H3,(H,10,11) |
| InChI Key | OEPHFGKBHIZAEN-UHFFFAOYSA-N |
| MDL Number | MFCD11047124 |
| Molecular Formula | C7H10ClN3 |
| Molecular Weight | 171.6274 |
| SMILES | CCNc1nc(Cl)ccc1N |
| Synonyms | 380378-92-7,
6-Chloro-2-N-ethylpyridine-2,3-diamine,
6-chloro-N2-ethylpyridine-2,3-diamine,
SCHEMBL1978195,
OEPHFGKBHIZAEN-UHFFFAOYSA-N,
MFCD11047124,
ZINC34479310,
AKOS006309742,
3-amino-6chloro-2-(ethylamino)pyridine,
3-amino-6-chloro-2-(ethylamino)pyridine,
6-Chloro-2-(ethylamino)pyridine-3-amine,
2,3-Pyridinediamine, 6-chloro-N2-ethyl-,
6-Chloro-N~2~-ethylpyridine-2,3-diamine,
6-chloro-N-ethyl-pyridine-2,3-diamine,
CID10797271,
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| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.628g/mol |
| Monoisotopic Mass | 171.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
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Certificate of Analysis
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