methyl 1-methyl-1H-1,2,3,4-tetrazole-5-carboxylate - CAS 32366-17-9
Catalog: |
BB021267 |
Product Name: |
methyl 1-methyl-1H-1,2,3,4-tetrazole-5-carboxylate |
CAS: |
32366-17-9 |
Synonyms: |
1-methyl-5-tetrazolecarboxylic acid methyl ester; methyl 1-methyltetrazole-5-carboxylate |
IUPAC Name: | methyl 1-methyltetrazole-5-carboxylate |
Description: | methyl 1-methyl-1H-1,2,3,4-tetrazole-5-carboxylate (CAS# 32366-17-9 ) is a useful research chemical. |
Molecular Weight: | 142.118 |
Molecular Formula: | C4H6N4O2 |
Canonical SMILES: | CN1C(=NN=N1)C(=O)OC |
InChI: | InChI=1S/C4H6N4O2/c1-8-3(4(9)10-2)5-6-7-8/h1-2H3 |
InChI Key: | RHUNHMQNQMVPCS-UHFFFAOYSA-N |
LogP: | -1.00330 |
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: | 139 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 142.04907545 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 142.04907545 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 69.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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