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(Q58826418)
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English
2H-tetrazole
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
tetrazole
0 references
mass
70.02794606399999
dalton
1 reference
based on heuristic
inferred from SMILES
tautomer of
1H-tetrazole
1 reference
stated in
ChEBI
retrieved
1 December 2018
title
2H-tetrazole
(English)
language of work or name
English
ChEBI ID
33194
5H-tetrazole
1 reference
stated in
ChEBI
retrieved
1 December 2018
title
2H-tetrazole
(English)
language of work or name
English
ChEBI ID
33194
chemical formula
CH₂N₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
c1nn[nH]n1
1 reference
stated in
ChEBI
title
2H-tetrazole
(English)
retrieved
17 November 2018
language of work or name
English
ChEBI ID
33194
Identifiers
InChI
InChI=1S/CH2N4/c1-2-4-5-3-1/h1H,(H,2,3,4,5)
1 reference
stated in
ChEBI
title
2H-tetrazole
(English)
retrieved
17 November 2018
language of work or name
English
ChEBI ID
33194
InChIKey
KJUGUADJHNHALS-UHFFFAOYSA-N
2 references
stated in
ChEBI
title
2H-tetrazole
(English)
retrieved
17 November 2018
language of work or name
English
ChEBI ID
33194
stated in
ChEBI release 2020-09-01
CAS Registry Number
100043-29-6
1 reference
stated in
ChEBI
title
2H-tetrazole
(English)
retrieved
17 November 2018
language of work or name
English
ChEBI ID
33194
PubChem CID
67519
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
KJUGUADJHNHALS-UHFFFAOYSA-N
Reaxys registry number
506742
1 reference
stated in
ChEBI
title
2H-tetrazole
(English)
retrieved
17 November 2018
language of work or name
English
ChEBI ID
33194
Gmelin number
1996628
1 reference
stated in
ChEBI
title
2H-tetrazole
(English)
retrieved
17 November 2018
language of work or name
English
ChEBI ID
33194
ChEBI ID
33194
mapping relation type
exact match
2 references
stated in
ChEBI
title
2H-tetrazole
(English)
retrieved
17 November 2018
language of work or name
English
ChEBI ID
33194
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/CH2N4/c1-2-4-5-3-1/h1H,(H,2,3,4,5)
33193
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/CH2N4/c1-2-4-5-3-1/h1H,(H,2,3,4,5)
MassBank accession ID
JP009496
0 references
JP009497
0 references
SPLASH
splash10-0006-9000000000-365fa31532edf6a8b9ff
0 references
splash10-002f-9000000000-af77c3483751bc5a46ad
0 references
NMRShiftDB structure ID
10016230
1 reference
matched by identifier from
InChIKey
InChIKey
KJUGUADJHNHALS-UHFFFAOYSA-N
DSSTox substance ID
DTXSID5075280
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
KJUGUADJHNHALS-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID9037876
0 references
Human Metabolome Database ID
HMDB0244905
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KJUGUADJHNHALS-UHFFFAOYSA-N
UNII
D34J7PAT68
1 reference
matched by identifier from
InChIKey
InChIKey
KJUGUADJHNHALS-UHFFFAOYSA-N
Probes And Drugs ID
PD158527
0 references
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