| CAS Number | 859877-40-0 |
| Catalog Number | AG00H3CQ(AGN-PC-0I4YHT) |
| Chemical Name | n-Methyl-2-nitro-5-propoxyaniline |
| IUPAC Name | N-methyl-2-nitro-5-propoxyaniline |
| InChI | InChI=1S/C10H14N2O3/c1-3-6-15-8-4-5-10(12(13)14)9(7-8)11-2/h4-5,7,11H,3,6H2,1-2H3 |
| InChI Key | TXAKVAMJZKEMRU-UHFFFAOYSA-N |
| MDL Number | MFCD24448840 |
| Molecular Formula | C10H14N2O3 |
| Molecular Weight | 210.2298 |
| SMILES | CCCOc1ccc(c(c1)NC)[N+](=O)[O-] |
| Synonyms | n-methyl-2-nitro-5-propoxyaniline,
859877-40-0,
N-methyl-2-nitro-5-propoxyBenzenamine,
SCHEMBL4011443,
ZINC95496099,
DA-02540,
FT-0748655,
V8147,
C10H14N2O3,
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| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.233g/mol |
| Monoisotopic Mass | 210.1g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 67.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number