Basic information
- CAS
14389-13-0- Standard SMILES
CCCc1nn[nH]n1- InChIKey
JAHCQVVOKAFXQU-UHFFFAOYSA-N- Molecular formula
- C4H8N4
- Average molar mass
- 112.13 g/mol
- Monoisotopic mass
- 112.07489627
Names & identifiers
- Preferred name
- 5-Propyl-2H-tetrazole
- IUPAC
- 5-propyl-2H-tetrazole
- English name
- 5-Propyl-2H-tetrazole
- Molecular formula
- C4H8N4
- Molecular weight
- 112.13
Names & synonyms
5-propyl-2h-tetrazole14389-13-0DTXSID20279034RefChem:1073240DTXCID702301905-propyl-1H-tetrazole5-propyl-1H-1,2,3,4-tetrazole2H-Tetrazole, 5-propyl-5-propyltetrazoleMFCD111560135-?Propyl-?1H-?tetraazolepropyltetrazole
Show more names
5-Propyl-1H-tetraazole5-propyl-2H-tetrazole（WS203091）
5-Propyl-2H-tetrazole; 5-Propyl-1H-tetrazole; 5-Propyltetrazole; NSC 11106;NSC11106SCHEMBL523100SCHEMBL523443SCHEMBL5234441,2,4,5-tetra-azolylpropanSCHEMBL3065106SCHEMBL5600795
Database identifiers
- CAS
14389-13-0- PubChem CID
- 223441
- DTXSID
DTXSID20279034- Nikkaji
- J398.049I
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 65.1
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Melting point
- 60 · 60-62°C
- storage temp.
- Refrigerator
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- color
- Off-White to Yellow
Chemistry & industry
Applications
Uses5-Propyl-1H-tetraazole is a potential antifungal agents.
Upstream & downstream products
Upstream raw materials
Suppliers13 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海堃睿化工科技有限公司+86-021-50935922
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海凯为化学科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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