5-Methoxy-2-methyl-3-nitroaniline - CAS 16024-30-9
Catalog: |
BB059172 |
Product Name: |
5-Methoxy-2-methyl-3-nitroaniline |
CAS: |
16024-30-9 |
Synonyms: |
5-Methoxy-2-methyl-3-nitroaniline; 2-amino-4-methoxy-6-nitrotoluene; 2-Nitro-4-methoxy-6-aminotoluol; 5-methoxy-2-methyl-3-nitroanilin |
IUPAC Name: | 5-methoxy-2-methyl-3-nitroaniline |
Description: | 5-Methoxy-2-methyl-3-nitroaniline (cas# 16024-30-9) is a useful research chemical. |
Molecular Weight: | 182.17 |
Molecular Formula: | C8H10N2O3 |
Canonical SMILES: | CC1=C(C=C(C=C1[N+](=O)[O-])OC)N |
InChI: | InChI=1S/C8H10N2O3/c1-5-7(9)3-6(13-2)4-8(5)10(11)12/h3-4H,9H2,1-2H3 |
InChI Key: | ZPNLWRNYOLNTCJ-UHFFFAOYSA-N |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.06914219 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.06914219 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 81.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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