Basic information
- CAS
422517-67-7- Standard SMILES
Cl.Cl.O=[N+]([O-])c1ccc(CN2CCNCC2)cc1- InChIKey
GGBDAQAYHNRAIY-UHFFFAOYSA-N- Molecular formula
- C11H17Cl2N3O2
- Average molar mass
- 294.17 g/mol
- Monoisotopic mass
- 293.0697822
Names & identifiers
- Preferred name
- 1-(4-Nitrobenzyl)piperazine dihydrochloride
- IUPAC
- 1-[(4-nitrophenyl)methyl]piperazine;dihydrochloride
- English name
- 1-(4-Nitrobenzyl)piperazine dihydrochloride
- Molecular formula
- C11H16ClN3O2
- Molecular weight
- 257.72
Names & synonyms
1-(4-Nitrobenzyl)piperazine dihydrochloride422517-67-776835-13-7MFCD049725811-(4-nitro-benzyl)-piperazine dihydrochloride1-[(4-nitrophenyl)methyl]piperazine dihydrochloride1-[(4-nitrophenyl)methyl]piperazine;dihydrochloridestarbld0009725SCHEMBL4478110DTXSID50592440GGBDAQAYHNRAIY-UHFFFAOYSA-N1-(4-Nitrobenzyl)piperazine diHCl
Show more names
1-(4-Nitrobenzyl)piperazine*2HCI1-(4-Nitrobenzyl)piperazine*2HCl1-(4-Nitrobenzyl)piperazinedihydrochloride97%4-[(Piperazin-1-yl)methyl]nitrobenzene dihydrochloride
SBB002977AKOS0159117621-(4-NITROBENZYL)PIPERAZINE 2HCLBP-10439BS-281821-(4-Nitrobenzyl)piperazinedihydrochloride1-(4-nitrobenzyl)-piperazinedihydrochlorideN-(4-nitrobenzyl)piperazine dihydrochloride
Database identifiers
- CAS
422517-67-7- PubChem CID
- 18005679
- DTXSID
DTXSID50592440
Properties
Computed structural properties
- Topological polar surface area
- 61.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 228
Physicochemical properties
- form
- powder
- color
- Beige to brown
- HS Code
- 2933599590 · 2933599590
Safety & regulation
Safety data
- hs_code
- 2933599590
Chemistry & industry
Suppliers7 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
盐城康迪森医药科技有限公司13812573443;18052965989 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
6 records
Compound notes
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