Basic information
- Standard SMILES
NCCCNCCO- InChIKey
GHKSKVKCKMGRDU-UHFFFAOYSA-N- Molecular formula
- C5H14N2O
- Average molar mass
- 118.18 g/mol
- Monoisotopic mass
- 118.11061307
Names & identifiers
- Preferred name
- N-(Aminopropyl)ethanolamine
- IUPAC
- 2-(3-aminopropylamino)ethanol
- English name
- N-(2-Hydroxyethyl)-1,3-propanediamine
- Molecular formula
- C5H14N2O
- Molecular weight
- 118.18
Names & synonyms
N-(2-Hydroxyethyl)-1,3-propanediamine4461-39-6n-(aminopropyl)ethanolamine2-((3-Aminopropyl)amino)ethanol2-[(3-aminopropyl)amino]ethanolEINECS 224-718-0Ethanol, 2-((3-aminopropyl)amino)-N-(2-Hydroxyethyl)-1,3-diaminopropane3-(2-HYDROXYETHYLAMINO)PROPYLAMINE594D12975JKOEI 3311DTXSID00196250
Show more names
HEAPA2-HYDROXYETHYLAMINO PROPYLAMINEEthanol, 2-[(3-aminopropyl)amino]-2-[(3-aMinopropyl)aMino]ethan-1-olN-(2-Hydroxyethyl)propan-1,3-diamineN-(2-hydroethyl)-1,3-propane diamine
1,3-DIAMINO-N-(2-HYDROXYETHYL)PROPANERefChem:828318DTXCID10118741224-718-02-(3-Aminopropylamino)ethanolMFCD00025617C5H14N2ON-(2-Hydroxyethyl)trimethylenediamine
Database identifiers
- CAS
4461-39-6- PubChem CID
- 78211
- DTXSID
DTXSID00196250- ChEMBL
CHEMBL361813- UNII
- 594D12975J
- EC Number
- 224-718-0
- Nikkaji
- J205.849I
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 58.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 41
Physicochemical properties
- Melting point
- 15 · 15-19 °C
- Boiling point
- 250 · 250-252 °C(lit.)
- Density
- 1.007 g/mL · 1.007 g/mL at 20 °C(lit.)
- refractive index
- 20 · n20/D 1.486
- Flash point
- 152 °C · 152 °C
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
- form
- Oil
- pka
- 14.79 · 14.79±0.10(Predicted)
- color
- Clear Colourless
- Specific Gravity
- 1.008 · 1.008
- Water Solubility
- miscible
- BRN
- 1734412 · 1734412
- InChI
- InChI=1S/C5H14N2O/c6-2-1-3-7-4-5-8/h7-8H,1-6H2
- InChIKey
- GHKSKVKCKMGRDU-UHFFFAOYSA-N
- SMILES
- C(O)CNCCCN
- CAS DataBase Reference
- 4461 · 4461-39-6(CAS DataBase Reference)
- FDA UNII
- 594 D12975J · 594D12975J
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
- Hazard Codes
- C
- Risk Statements
- 34 · 34-37-35
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 2735 · UN 2735 8/PG 3
- WGK Germany
- 3 · 3
- HazardClass
- 8 · 8
- PackingGroup
- III
- HS Code
- 29221980 · 29221980
- 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
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 5 notifications to the ECHA C&L Inventory.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Safety data
- wgk
- 3
- ridadr
- UN 2735 8/PG 3
- hs_code
- 29221980
- risk_code
- 34-37-35
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- packing_group
- III
- Hazard statements
- H314
- 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)
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Applications
UsesCuring epoxy resins.
Suppliers50 total
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
广州佳途科技股份有限公司81960175 18933936954 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
湖北云镁科技有限公司027-59206672 18995657604 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海颖心实验室设备有限公司021-59178156 17002132182 · [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]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
湖北微斯汀科技有限公司027-61182895 13367240285 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
镇江卡博医药科技有限公司0511-81886918 18136818960 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
上海嵩爰化工科技有限公司010-1234567 18521000990 · [email protected]
舟山市艾科生物科技有限公司18957583039 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
诺尔凯立科技有限公司86-(0)21-31261262 373522135 · [email protected]
中山市迪欣化工有限公司19849939632; 19849939632 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
科瑞希（天津）新材料技术有限公司022-83945173 18622315263 · [email protected]
上海炎泽化工有限公司15345144255 19901447308 · [email protected]
Related reactions
2 records
Linked notes
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