Basic information
- Standard SMILES
CCCNCCN- InChIKey
CFNHVUGPXZUTRR-UHFFFAOYSA-N- Molecular formula
- C5H14N2
- Average molar mass
- 102.18 g/mol
- Monoisotopic mass
- 102.11569845
Names & identifiers
- Preferred name
- 1-Propylethylenediamine
- IUPAC
- N'-propylethane-1,2-diamine
- English name
- N-(N-Propyl)ethylenediamine
- Molecular formula
- C5H14N2
- Molecular weight
- 102.18
Names & synonyms
N-(N-Propyl)Ethylenediamine111-39-7N-Propylethylenediamine1,2-Ethanediamine, N-propyl-Ethylenediamine, N-propyl-1-propylethylenediamine1,2-Ethanediamine, N1-propyl-27PM61K8YHEINECS 203-864-9NSC 166324NSC-166324n1-propyl-1,2-ethanediamine
Show more names
2-PROPYLAMINOETHYLAMINEPropyl(2-aminoethyl)amineN-Propylethane-1,2-diamineN-Propyl-1,2-ethanediamineN1-propylethane-1,2-diaMineN-Propylethylenediamine,99%2-(N-PROPYLAMINO)ETHYLAMINE
DTXSID5059400RefChem:436482DTXCID8033196Ethylenediamine, N-propyl-(8CI)203-864-9N'-propylethane-1,2-diamineMFCD00008172(2-aminoethyl)(propyl)amine
Database identifiers
- CAS
111-39-7- PubChem CID
- 66073
- DTXSID
DTXSID5059400- UNII
- 27PM61K8YH
- EC Number
- 203-864-9
- Nikkaji
- J193.592E
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 29.3
Physicochemical properties
- Melting point
- -30.89 °C · -30.89°C (estimate)
- Boiling point
- 147 · 147-150 °C (lit.)
- Density
- 0.829 g/mL · 0.829 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.441(lit.)
- Flash point
- 59 °F · 59 °F
- storage temp.
- Flammables area
- form
- Liquid
- pka
- 10.26 · 10.26±0.19(Predicted)
- color
- Clear colorless
- Sensitive
- Air Sensitive
- BRN
- 1697232 · 1697232
- InChI
- 1S/C5H14N2/c1-2-4-7-5-3-6/h7H,2-6H2,1H3
- InChIKey
- CFNHVUGPXZUTRR-UHFFFAOYSA-N
- SMILES
- CCCNCCN
- FDA UNII
- 27 PM61K8YH · 27PM61K8YH
- EPA Substance Registry System
- 1 · 1,2-Ethanediamine, N-propyl- (111-39-7)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Warning
- Hazard statements
- 226 · H226-H315-H335
- Precautionary statements
- 210 · P210-P302+P352
- target organs
- Respiratory system
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi,C,F
- Risk Statements
- 10 · 10-37/38
- Safety Statements
- 23 · 23
- RIDADR
- 2734 · UN 2734 8/PG 2
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HazardClass
- 3 · 3
- PackingGroup
- II
- HS Code
- 29212900 · 29212900
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 3 Skin · Flam. Liq. 3Skin Irrit. 2STOT SE 3
- Limited Quantities
- 1 L · 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Warning
H226 (97.7%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P319, P321, P332+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (97.7%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2734 8/PG 2
- hs_code
- 29212900
- risk_code
- 10-37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- Xi,C,F
- safety_code
- 23
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- target organs
- Respiratory system
- Hazard statements
- H226-H315-H335
- Limited Quantities
- 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- Hazard Classifications
- Flam. Liq. 3Skin Irrit. 2STOT SE 3
- Precautionary statements
- P210-P302+P352
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,2-Ethanediamine, N1-propyl-: INACTIVE
Applications
UsesN-Propylethylenediamine was used in the synthesis of N-acetyl-N′-propylethylenediamine.
General DescriptionN-Propylethylenediamine columns help in quantitatively removing Cu(2+) from buffered solutions at pH 6.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers45 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
北京伊诺凯科技有限公司400-810-7969 010-59572699 · [email protected]
上海熙誉化学科技有限公司021-15000143735 15221126179 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [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]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
上海玻尔化学试剂有限公司19102157732 · [email protected]
上海珈得尔化学技术有限公司021-4007787-550 400-7787-550 · [email protected]
韶关新润合生物科技有限公司19022763608 19022763608 · [email protected]
科瑞希（天津）新材料技术有限公司022-83945173 18622315263 · [email protected]
北京华威锐科化工科技有限公司89508211 18501085097 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
安徽酷尔生物工程有限公司0551-65171243 13856024262 · [email protected]
广州市金华大化学试剂有限公司020-84383047 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海启乔生物科技有限公司021-37653318 15221675714 · [email protected]
上海易恩化学技术有限公司400-400-1332688 18019345275 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
合肥博美生物科技有限责任公司13739298932 13856598764 · [email protected]
Aladdin Scientific[email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
河南奥创化工有限公司+86-0371-63689365 +8618638391208 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318584237 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
广州安纳医药科技有限公司020-86211473 13925088720 · [email protected]
上海齐奥化工科技有限公司021-58892003 · [email protected]
天津易创成医药技术有限公司022-83946278 13820503911 · [email protected]
Related reactions
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