Basic information
- CAS
106-59-2- Standard SMILES
NN1CCN(N)CC1- InChIKey
PVCOXMQIAVGPJN-UHFFFAOYSA-N- Molecular formula
- C4H12N4
- Average molar mass
- 116.17 g/mol
- Monoisotopic mass
- 116.1061964
Names & identifiers
- Preferred name
- 1,4-Piperazinediamine
- IUPAC
- piperazine-1,4-diamine
- English name
- 1,4-diaminopiperazine hydrate
- Molecular formula
- C4H12N4
- Molecular weight
- 116.16
Names & synonyms
1,4-Piperazinediamine106-59-21,4-DiaminopiperazineDTXSID60147460RefChem:1053374DTXCID6069951203-413-6piperazine-1,4-diamineN,N'-DiaminopiperazineRifapentine Impurity 61,4-DIAMINOPIPERAZINE HYDRATEMFCD00513438
Show more names
Piperazine Impurity 5
EINECS 203-413-6NSC 47228Piperazine, 1,4-diamino-AI3-60206NSC47228Piperazine,4-diamino-SCHEMBL137290SCHEMBL9404850
Database identifiers
- CAS
106-59-2- PubChem CID
- 29974
- DTXSID
DTXSID60147460- EC Number
- 203-413-6
- Nikkaji
- J182.213F
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 58.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 56.4
Physicochemical properties
- Melting point
- 238 °C · 238 °C (decomp)
- Boiling point
- 192.5 · 192.5±33.0 °C(Predicted)
- Density
- 1.119 · 1.119±0.06 g/cm3(Predicted)
- pka
- 8.04 · 8.04±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers15 total
安礼特（上海）医药科技有限公司18109805911 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
广州市桐晖药业有限公司020-66392521-118 18922260391 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 18012923235 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海择睿生物科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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