5-Aminotetrazole

CH₃N₅CAS 4418-61-585.07 g/mol

Open in Covalent MOL file

Properties

Molecular formula: CH₃N₅
Molar mass: 85.07 g/mol
Exact mass: 85.0388 Da
Density: 1.5 g/mL
Melting point: 202 °C (decomposes)
logP: -1.39Crippen estimate
Polar surface area: 81.2 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed26.3% of notifiers
H315 Causes skin irritation25.4% of notifiers
H318 Causes serious eye damage69.3% of notifiers
H319 Causes serious eye irritation25.4% of notifiers
H335 May cause respiratory irritation25.4% of notifiers
H412 Harmful to aquatic life with long lasting effects72.2% of notifiers

Aggregated from 205 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

4418-61-5

SMILES

N=c1nn[nH][nH]1

InChIKey

ULRPISSMEBPJLN-UHFFFAOYSA-N

InChI

InChI=1S/CH3N5/c2-1-3-5-6-4-1/h(H3,2,3,4,5,6)

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

18 names · show all

2H-Tetrazol-5-amine
1H-Tetrazole, 5-amino-
1H-Tetrazol-5-amine
Tetrazole, 5-amino-
1,2,3,4-Tetrazole, 5-amino-
Aminotetrazole
5-Amino-1H-tetrazole
5-Amino-1,2,3,4-tetrazole
Thiolite HAT 1
1H-Tetrazol-5-ylamine
NSC 3004
5-Amino-2H-tetrazole
B 6030
HAT
Tetrazol-5-amine
1H-1,2,3,4-Tetrazol-5-amine
1H-Tetraazol-5-amine
Tetrazolamine

Work with 5-Aminotetrazole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

5-Aminotetrazole monohydrate15454-54-3Hydrate Aminotetrazole5378-49-4

Similar compounds

3-Amino-1,2,4-triazole61-82-532 % similar 3-Amino-5-mercapto-1,2,4-triazole16691-43-331 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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