Basic information
- CAS
934-98-5- Standard SMILES
CN1CCN(CCN)CC1- InChIKey
GOWUDHPKGOIDIX-UHFFFAOYSA-N- Molecular formula
- C7H17N3
- Average molar mass
- 143.23 g/mol
- Monoisotopic mass
- 143.14224754
Overview
2-(4-methyl-1-piperazinyl)ethanamine is a N-alkylpiperazine that is piperazine substituted by a methyl and a 2-aminoethyl group at the N atoms respectively. It has a role as a human metabolite.
Names & identifiers
- Preferred name
- 4-Methylpiperazine-1-ethylamine
- IUPAC
- 2-(4-methylpiperazin-1-yl)ethanamine
- English name
- 4-Methyl-1-piperazineethanamine
- Molecular formula
- C7H17N3
- Molecular weight
- 143.23
Names & synonyms
2-(4-methylpiperazin-1-yl)ethanamine4-methyl-1-piperazineethanamine1-Piperazineethanamine, 4-methyl-2-(4-methylpiperazin-1-yl)ethan-1-amine2-(4-Methyl-1-piperazinyl)ethanamine4-Methylpiperazine-1-ethylamine2-(4-methylpiperazin-1-yl)ethylamineZ79BOY08I2EINECS 213-296-3UNII-Z79BOY08I2CHEBI:84290DTXSID10239420
Show more names
AKOS BB-6128CHEMBRDG-BB 40063834-Methylpiperazin-1-ethylamin1-(2-AMINOETHYL)METHYLPIPERAZINE1-(2-Aminoethyl)-4-methyl-piperaz1-Methyl-4-(2-aminoethyl)piperazine
2-(4-METHYLPIPERAZINO)ETHANAMINEPiperazine 1-[2-aminoethyl]-4-methyl-Piperazine, 1-(2-aminoethyl)-4-methyl-4-(2-AMINOETHYL)-1-METHYLPIPERAZINEPiperazine 1-(2-aminoethyl)-4-methyl-RefChem:99932DTXCID30161911213-296-3
Database identifiers
- CAS
934-98-5- PubChem CID
- 70284
- DTXSID
DTXSID10239420- ChEBI
CHEBI:84290- UNII
- Z79BOY08I2
- EC Number
- 213-296-3
- Nikkaji
- J298.525J
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 32.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 86.9
Physicochemical properties
- Boiling point
- 103 °C/11.25mm · 103°C/11.25mm
- Density
- 0.956 · 0.956±0.06 g/cm3(Predicted)
- refractive index
- 1.478 · 1.4780
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- liquid
- pka
- 10.11 · 10.11±0.10(Predicted)
- color
- Colourless to light yellow
- Sensitive
- Air Sensitive
- InChI
- InChI=1S/C7H17N3/c1-9-4-6-10(3-2-8)7-5-9/h2-8H2,1H3
- InChIKey
- GOWUDHPKGOIDIX-UHFFFAOYSA-N
- SMILES
- N1(CCN)CCN(C)CC1
- CAS DataBase Reference
- 934 · 934-98-5(CAS DataBase Reference)
- FDA UNII
- 79 BOY08I2 · Z79BOY08I2
- UNSPSC Code
- 12352116 · 12352116
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P501
- Hazard Codes
- Xi,Xn
- Risk Statements
- 36 · 36/37/38-22
- Safety Statements
- 26 · 26-36/37/39
- RIDADR
- 2735 · 2735
- WGK Germany
- 3 · WGK 3
- Hazard Note
- Irritant
- HazardClass
- 8 · 8
- PackingGroup
- Ⅲ
- HS Code
- 29339900 · 29339900
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 Oral · Acute Tox. 4 Oral
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (11.1%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 9 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (11.1%)
Safety data
- wgk
- WGK 3
- ridadr
- 2735
- hs_code
- 29339900
- risk_code
- 36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- hazard_note
- Irritant
- safety_code
- 26-36/37/39
- hazard_class
- 8
- Storage Class
- 11 - Combustible Solids
- packing_group
- Ⅲ
- Hazard statements
- H302
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Hazard Classifications
- Acute Tox. 4 Oral
- Precautionary statements
- P264-P270-P301+P312-P501
Chemistry & industry
Applications
Uses2-(4-Methylpiperazin-1-yl)ethanamine (cas# 934-98-5) is a useful research chemical.
Uses1-(2-Aminoethyl)-4-methylpiperazine is used as pharmaceutical intermediate.
Upstream & downstream products
Upstream raw materials
Suppliers100 total
上海康恩博医药科技有限公司17510465506 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
武汉贺景行生物科技有限公司027-13277920701 13277920701 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海炎泽化工有限公司15345144255 19975051755 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
深圳睿迅光电材料科技有限公司0755-26718755; 15889762949 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海基玉医药科技有限公司02161739128 13816953660 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
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上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海钰康生物科技有限公司18939844854 · [email protected]
成都安米诺泰医药科技有限公司028-85755578 18140172005 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
上海攀鸿化工科技有限公司021-56491756 13512199871 · [email protected]
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山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
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苏州岚云医药科技有限公司2332782371 · [email protected]
武汉信嘉和诚药物化学有限公司+86-027-87166955 · [email protected] [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
北京阳光福润科技有限公司010-57495520 13521095525 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
天津荣燊化工有限公司18317763565; 18317763565 · [email protected]
成都瑞欧克科技有限公司028-64353063 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
韶关新润合生物科技有限公司19022763608 19022763608 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
武汉贺景行生物科技有限公司18971200136
成都润泽本土化工有限公司028-88469284 18000562381 · [email protected]
上海岚克医药科技发展有限公司0086-21-58956006
上海天习化工有限公司021-20960837,QQ1332204249 · [email protected]
科瑞希（天津）新材料技术有限公司022-83945173 18622315263 · [email protected]
Additional notes
DefinitionChEBI: A N-alkylpiperazine that is piperazine substituted by a methyl and a 2-aminoethyl group at the N atoms respectively.
Related reactions
43 records
Compound notes
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