5-[(Benzyloxy)methyl]-1-methyl-1H-tetrazole - CAS 2108176-82-3
Catalog: |
BB016596 |
Product Name: |
5-[(Benzyloxy)methyl]-1-methyl-1H-tetrazole |
CAS: |
2108176-82-3 |
Synonyms: |
1-methyl-5-(phenylmethoxymethyl)tetrazole; 1-methyl-5-(phenylmethoxymethyl)tetrazole |
IUPAC Name: | 1-methyl-5-(phenylmethoxymethyl)tetrazole |
Description: | 5-[(Benzyloxy)methyl]-1-methyl-1H-tetrazole (CAS# 2108176-82-3 ) is a useful research chemical. |
Molecular Weight: | 204.23 |
Molecular Formula: | C10H12N4O |
Canonical SMILES: | CN1C(=NN=N1)COCC2=CC=CC=C2 |
InChI: | InChI=1S/C10H12N4O/c1-14-10(11-12-13-14)8-15-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3 |
InChI Key: | KILCNJINEIERTB-UHFFFAOYSA-N |
Complexity: | 184 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 204.10111102 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.10111102 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 52.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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