1-Methyl-5-nitro-1,2,3-triazole - CAS 1204736-25-3
Catalog: |
BB004881 |
Product Name: |
1-Methyl-5-nitro-1,2,3-triazole |
CAS: |
1204736-25-3 |
Synonyms: |
1-methyl-5-nitrotriazole; 1-methyl-5-nitrotriazole |
IUPAC Name: | 1-methyl-5-nitrotriazole |
Description: | 1-Methyl-5-nitro-1,2,3-triazole (CAS# 1204736-25-3 ) is a useful research chemical. |
Molecular Weight: | 128.09 |
Molecular Formula: | C3H4N4O2 |
Canonical SMILES: | CN1C(=CN=N1)[N+](=O)[O-] |
InChI: | InChI=1S/C3H4N4O2/c1-6-3(7(8)9)2-4-5-6/h2H,1H3 |
InChI Key: | BWGRZGKYADPMCI-UHFFFAOYSA-N |
LogP: | 0.24650 |
Publication Number | Title | Priority Date |
EP-3183250-A1 | Process for preparing crystalline organic semiconductor material | 20140818 |
EP-3183757-A1 | Organic semiconductor composition comprising liquid medium | 20140818 |
JP-2017528447-A | Method for producing crystalline organic semiconductor material | 20140818 |
JP-2017532768-A | Organic semiconductor composition containing liquid medium | 20140818 |
KR-20170042358-A | Organic semiconductor composition comprising liquid medium | 20140818 |
Complexity: | 122 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 128.03342538 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 128.03342538 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 76.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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