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1-Methyl-4-(5-nitropyridin-2-yl)piperazine

HCID 2764066
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
55403-34-4
Standard SMILES
CN1CCN(c2ccc([N+](=O)[O-])cn2)CC1
InChIKey
DZIASOMGGPNYCU-UHFFFAOYSA-N
Molecular formula
C10H14N4O2
Average molar mass
222.24 g/mol
Monoisotopic mass
222.1116757

Names & identifiers

Preferred name
1-Methyl-4-(5-nitropyridin-2-yl)piperazine
IUPAC
1-methyl-4-(5-nitro-2-pyridinyl)piperazine
English name
2-(4-Methylpiperazin-1-yl)-5-nitropyridine
Molecular formula
C10H14N4O2
Molecular weight
222.24

Names & synonyms

55403-34-41-methyl-4-(5-nitropyridin-2-yl)piperazineDTXSID50377279RefChem:231845DTXCID503283071-methyl-4-(5-nitro-2-pyridinyl)piperazine2-(4-Methyl-1-piperazinyl)-5-nitropyridine2-(4-Methylpiperazin-1-yl)-5-nitropyridineMFCD03001270Piperazine, 1-methyl-4-(5-nitro-2-pyridinyl)-4-methyl-1-(5-nitro(2-pyridyl))piperazine1-methyl-4-(5
Show more names
1-Methyl-4-(5-nitropyridin-2-yl)
1-methyl-4-(5-nitro-2-pyridyl)piperazine1-Methyl-4-(5-nitro-pyridin-2-yl)-piperazineSCHEMBL854731SCHEMBL30464683DZIASOMGGPNYCU-UHFFFAOYSA-NSBB096320STL406349AKOS001299543

Database identifiers

CAS
55403-34-4
PubChem CID
2764066
DTXSID
DTXSID50377279
EC Number
998-614-5

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
65.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
248

Physicochemical properties

Melting point
108 · 108-110°
storage temp.
2 · 2-8°C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
HazardClass
IRRITANT
HS Code
2933599590 · 2933599590

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 5 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%);Acute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Dam. 1 (100%);Acute Tox. 4 (100%);STOT SE 3 (100%)

Safety data

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

Chemistry & industry

Upstream & downstream products

Upstream raw materials

1-Methylpiperazine2-Bromo-5-nitropyridine2-Chloro-5-nitropyridineN,N-DimethylformamidePotassium carbonate

Downstream products

3-Pyridinamine, N-methyl-4-(2-methylphenyl)-6-(4-methyl-1-piperazinyl)-

Suppliers58 total

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
长沙麓兴生物科技有限公司0731-88827538 15574813303 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
学研惠(武汉)科技有限公司15727060112 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
武汉艾瑞尔化学科技有限公司18986259541 18986259541 · [email protected]
济南千叶医药技术有限公司0531-81313138 13066006660 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
上海特伯化学科技有限公司+86-21-60341587 · [email protected]
河南赢创生物科技有限公司15672878902 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海市凯瑜琳医药科技有限公司021-18721936-595 18721936595 · [email protected]
Accela ChemBio Inc.+1(858) 699-3322 · [email protected]
南兴化工(江苏)有限公司0512-66387035 18662433356 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
Jinan Honest Pharm Co., Ltd[email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
郑州艾克姆化工有限公司0371-0371-55629727 13323845623 · [email protected]
杭州摩库生物医药科技有限公司400-711-5280 86-571-81025280 · [email protected]
四川铂友生物科技有限公司(原四川佰朋)028-65791793 18140026355 · [email protected]
济南千叶医药技术有限公司70803088888 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
苏州诺欧曼生物科技有限公司15026866316 · [email protected]
武汉千恒瑞泰生物医药科技有限公司15610156652 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
上海珂华生物科技有限公司021-58581007 18019463053 · [email protected]
武汉德克瑞生物医药科技有限公司027-69573188 18221423799 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
天津凯芾医药科技有限公司18081075745 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
Aladdin Scientific[email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
苏州启航生物科技有限公司18662190603 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]

Related reactions

12 records
New reaction record
HRID 200183 reaction equation
HRID 200183As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 268252 reaction equation
HRID 268252As productuspto-grants-1976_03
HRID 379372 reaction equation
HRID 379372As productuspto-grants-2001_10
HRID 668267 reaction equation
HRID 668267As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 854389 reaction equation
HRID 854389As productuspto-grants-2007_08
HRID 854390 reaction equation
HRID 854390As reactantuspto-grants-2007_08
HRID 1017432 reaction equation
HRID 1017432As productuspto-grants-2002_11
HRID 1575555 reaction equation
HRID 1575555As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes