| CAS Number | 13175-00-3 |
| Catalog Number | AG000ZP6(AGN-PC-0JP0F9) |
| Chemical Name | 2H-Tetrazole-5-carboxylic acid, 2-methyl- |
| IUPAC Name | 2-methyltetrazole-5-carboxylic acid |
| InChI | InChI=1S/C3H4N4O2/c1-7-5-2(3(8)9)4-6-7/h1H3,(H,8,9) |
| InChI Key | VQHZPBXUOJDGTE-UHFFFAOYSA-N |
| MDL Number | MFCD19228302 |
| Molecular Formula | C3H4N4O2 |
| Molecular Weight | 128.0895 |
| NSC Number | 282055 |
| SMILES | O=C(C1=NN(C)N=N1)O |
| Synonyms | 13175-00-3,
2-methyltetrazole-5-carboxylic acid,
2-methyl-2H-tetrazole-5-carboxylic acid,
2-methyl-2H-1,2,3,4-tetrazole-5-carboxylic acid,
SCHEMBL3642265,
CTK0I1207,
DTXSID00314336,
VQHZPBXUOJDGTE-UHFFFAOYSA-N,
AC1L8837,
ZINC1564369,
NSC282055,
AKOS006380142,
NSC-282055,
2H-Tetrazole-5-carboxylic acid, 2-methyl-,
Z1205494128,
CID323194,
NSC282060,
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| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 128.091g/mol |
| Monoisotopic Mass | 128.033g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 80.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number