ethyl 1-methyl-1H-1,2,3,4-tetrazole-5-carboxylate - CAS 91616-41-0
Catalog: |
BB040278 |
Product Name: |
ethyl 1-methyl-1H-1,2,3,4-tetrazole-5-carboxylate |
CAS: |
91616-41-0 |
Synonyms: |
1-methyl-5-tetrazolecarboxylic acid ethyl ester; ethyl 1-methyltetrazole-5-carboxylate |
IUPAC Name: | ethyl 1-methyltetrazole-5-carboxylate |
Description: | ethyl 1-methyl-1H-1,2,3,4-tetrazole-5-carboxylate (CAS# 91616-41-0 ) is a useful research chemical. |
Molecular Weight: | 156.145 |
Molecular Formula: | C5H8N4O2 |
Canonical SMILES: | CCOC(=O)C1=NN=NN1C |
InChI: | InChI=1S/C5H8N4O2/c1-3-11-5(10)4-6-7-8-9(4)2/h3H2,1-2H3 |
InChI Key: | JMPPMYKMIXZZRM-UHFFFAOYSA-N |
LogP: | -0.61320 |
Publication Number | Title | Priority Date |
TW-202019406-A | Substituted tetrahydrocyclopenta[c]pyrrole, substituted dihydropyrrole, their analogues and methods of using them | 20180727 |
CN-112638376-A | Substituted tetrahydrocyclopenta [ c ] pyrroles, substituted dihydropyrrolizines, analogs thereof and methods of use thereof | 20180727 |
KR-20210039417-A | Substituted tetrahydrocyclopenta[c]pyrrole, substituted dihydropyrrolysine, analogs thereof, and methods of use thereof | 20180727 |
US-2021179557-A1 | Substituted tetrahydrocyclopenta[c]pyrroles, substituted dihydropyrrolizines, analogues thereof, and methods using same | 20180727 |
US-2020282016-A1 | Endoparasitic Depsipeptides | 20171129 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.06472551 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.06472551 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 69.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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