Basic information
- Standard SMILES
COc1ccc(Cn2nnc(C(=O)O)n2)cc1- InChIKey
GILWHMFYKTWDRN-UHFFFAOYSA-N- Molecular formula
- C10H10N4O3
- Average molar mass
- 234.21 g/mol
Names & identifiers
- Preferred name
- 2-(4-Methoxybenzyl)-2h-tetrazole-5-carboxylic acid
- IUPAC
- 2-[(4-methoxyphenyl)methyl]tetrazole-5-carboxylic acid
Names & synonyms
2-(4-methoxybenzyl)-2h-tetrazole-5-carboxylic acid70978-20-02-(4-methoxybenzyl)-2h-tetrazole-5-carboxylicacid1194509-58-42-[(4-methoxyphenyl)methyl]tetrazole-5-carboxylic acid2-[(4-methoxyphenyl)methyl]-2H-1,2,3,4-tetrazole-5-carboxylic acidSCHEMBL1912587GILWHMFYKTWDRN-UHFFFAOYSA-NDB-226627EN300-310997F180122-(4-methoxy-benzyl)-2H-tetrazole-5-carboxylic acid
Database identifiers
- PubChem CID
- 13596244
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 90.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 268
Related reactions
14 records
Compound notes
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