1-(4-Nitrobenzyl)piperidine

HCID 783541
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Basic information

CAS
59507-44-7
Standard SMILES
O=[N+]([O-])c1ccc(CN2CCCCC2)cc1
InChIKey
PAMJENUKCYUKLC-UHFFFAOYSA-N
Molecular formula
C12H16N2O2
Average molar mass
220.27 g/mol
Monoisotopic mass
220.12117775

Names & identifiers

Preferred name
1-(4-Nitrobenzyl)piperidine
IUPAC
1-[(4-nitrophenyl)methyl]piperidine
English name
1-(4-nitrobenzyl)piperidine
Molecular formula
C12H16N2O2
Molecular weight
220.27

Names & synonyms

1-(4-nitrobenzyl)piperidine59507-44-71-[(4-nitrophenyl)methyl]piperidineMFCD014532781-[(4-Nitrophenyl)methyl]-piperidine1-(4-nitrophenylmethyl)piperidinePiperidine, 1-[(4-nitrophenyl)methyl]-4-nitrobenzylpiperadine4-nitrobenzylpiperidineCambridge id 5430648Oprea1_443263SCHEMBL1805498
Show more names
1-(4-nitro-benzyl)-piperidineSCHEMBL23832519DTXSID60354819AKOS015905105SB434771-[(4-nitrophenyl)-methyl]-piperidine4-(piperidin-1-yl-methyl)-nitrobenzeneAS-40151

Database identifiers

CAS
59507-44-7
PubChem CID
783541
DTXSID
DTXSID60354819
Nikkaji
J2.459.239A

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
49.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
HS Code
2933599590 · 2933599590

Safety & regulation

Safety data

hs_code
2933599590
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Suppliers15 total

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]

Related reactions

35 records
New reaction record

Compound notes

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