Basic information
- CAS
21743-64-6- Standard SMILES
O=C(O)Cn1ncnn1- InChIKey
ZYHXBGMQUWRUBE-UHFFFAOYSA-N- Molecular formula
- C3H4N4O2
- Average molar mass
- 128.09 g/mol
- Monoisotopic mass
- 128.03342538
Names & identifiers
- Preferred name
- 2H-Tetrazol-2-acetic acid
- IUPAC
- 2-(tetrazol-2-yl)acetic acid
- English name
- 2H-tetrazol-2-acetic acid
- Molecular formula
- C3H4N4O2
- Molecular weight
- 128.09
Names & synonyms
21743-64-62H-Tetrazol-2-acetic acid2h-tetrazole-2-acetic acidDTXSID00176138EINECS 244-562-7RefChem:484429DTXCID6098629244-562-72H-tetrazol-2-ylacetic acid2H-Tetrazole-2-aceticacid2-(tetrazol-2-yl)acetic acid2-(2H-1,2,3,4-tetrazol-2-yl)acetic acid
Show more names
Cefazolin Impurity 412H-tetrazol-2-ylacetic acid(SALTDATA: FREE)
MFCD00461719Cefazolin Impurity 422-(2H-tetrazol-2-yl)acetic acid2-(2-Tetrazolyl)acetic Acid2h-tetrazolylacetic acid2-Tetrazolylacetic acidCefazolin Impurity N142-Tetrazole acetic acid
Database identifiers
- CAS
21743-64-6- PubChem CID
- 89030
- DTXSID
DTXSID00176138- UNII
- 5YR9K3ZG9E
- EC Number
- 244-562-7
- Nikkaji
- J225.430A
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 116
Physicochemical properties
- Boiling point
- 381.1 · 381.1±44.0 °C(Predicted)
- Density
- 1.78 · 1.78±0.1 g/cm3(Predicted)
- pka
- 2.28 · 2.28±0.10(Predicted)
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H228-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P210-P240-P241-P280-P370+P378
Safety & regulation
GHS classification
GHS Classification
Danger
H228 (100%): Flammable solid [Danger Flammable solids]
P210, P240, P241, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Sol. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- Hazard statements
- H335-H228-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P210-P240-P241-P280-P370+P378
Chemistry & industry
Suppliers9 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
希瓦生物科技（广州）有限公司13268215580 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
上海相辉医药科技有限公司[email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
1 records
Compound notes
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