Basic information
- CAS
38104-45-9- Standard SMILES
Nc1nncn1N- InChIKey
VVICLQXCPOEFTM-UHFFFAOYSA-N- Molecular formula
- C2H5N5
- Average molar mass
- 99.1 g/mol
- Monoisotopic mass
- 99.05449518
Names & identifiers
- Preferred name
- 3,4-Diamino-1,2,4-triazole
- IUPAC
- 1,2,4-triazole-3,4-diamine
- English name
- 4H-1,2,4-Triazole-3,4-diamine
- Molecular formula
- C2H5N5
- Molecular weight
- 0
Names & synonyms
3,4-Diamino-1,2,4-triazoleRefChem:909934H-1,2,4-Triazole-3,4-diamine38104-45-91,2,4-triazole-3,4-diamine5-Imino-1,5-dihydro-4H-1,2,4-triazol-4-amine3,4-diamino-4H-1,2,4-triazole3,4-Diamino-1,2,4(4H)-triazoleSCHEMBL971367DTXSID60959060ALBB-030352STL436398
Show more names
AKOS0014877924H-1,2,4-Triazole-3,4-diamine #DB-069638CS-0271106EN300-143890F0915-7974
Database identifiers
- CAS
38104-45-9- PubChem CID
- 567144
- DTXSID
DTXSID60959060- Nikkaji
- J2.980.988G
Properties
Computed structural properties
- XLogP
- -1.2
- Topological polar surface area
- 82.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 63
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information4H-1,2,4-Triazole-3,4-diamine: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Regulatory information
Regulatory Information4H-1,2,4-Triazole-3,4-diamine: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Chemistry & industry
Suppliers4 total
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
上海双锕化学科技有限公司15010167677 · [email protected]
R.R Scientific Co., Ltd.+86-13917743231 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
Related reactions
4 records
Compound notes
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