Basic information
- CAS
81731-43-3- Standard SMILES
CC(C)OCCN- InChIKey
USECIYVEPXUVHT-UHFFFAOYSA-N- Molecular formula
- C5H13NO
- Average molar mass
- 103.16 g/mol
- Monoisotopic mass
- 103.09971404
Names & identifiers
- Preferred name
- 2-(Propan-2-yloxy)ethan-1-amine
- IUPAC
- 2-propan-2-yloxyethanamine
- English name
- 2-Isopropoxy-ethylamine
- Molecular formula
- C5H13NO
- Molecular weight
- 103.16
Names & synonyms
2-(propan-2-yloxy)ethan-1-amineRefChem:462037672-759-12-Isopropoxyethanamine81731-43-32-Isopropoxyethylamine2-Isopropoxy-ethylamine2-Aminoethyl Isopropyl Ether2-propan-2-yloxyethanamine2-Isopropoxyethan-1-amineMFCD001916032-aminoethyl isopropylether
Show more names
aminoethylisopropyletherASINEX-REAG BAS 076797862-Aminoethyl Isopropyl Ether >
Ethanamine, 2-(1-methylethoxy)-2-aminoethylisopropylether2-(1-methylethoxy)Ethanamine2-Isopropoxyethaneamine2-isopropoxy ethylamine2-(isopropoxy)ethylamine2-Isopropoxyethanamine #2-(methylethoxy)ethylamine
Database identifiers
- CAS
81731-43-3- PubChem CID
- 533866
- DTXSID
DTXSID50336447- EC Number
- 672-759-1
- Nikkaji
- J534.002K
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 37.1
Physicochemical properties
- Boiling point
- 120 °C · 120°C
- Density
- 0 · 0,84 g/cm3
- refractive index
- 1.407 · 1.4070-1.4120
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 8.98 · 8.98±0.10(Predicted)
- form
- clear liquid
- color
- Colorless to Almost colorless
- InChI
- 1S/C5H13NO/c1-5(2)7-4-3-6/h5H,3-4,6H2,1-2H3
- InChIKey
- USECIYVEPXUVHT-UHFFFAOYSA-N
- SMILES
- CC(C)OCCN
- UNSPSC Code
- 12352116 · 12352116
- Symbol(GHS)
- 2 · GHS02,GHS05
- Signal word
- Danger
- Hazard statements
- 226 · H226-H314
- Precautionary statements
- 210 · P210-P233-P240-P241+P242+P243-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P370+P378-P403+P235-P405-P501
Safety & regulation
GHS classification
GHS Classification
Danger
H226 (66.7%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P272, P280, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P332+P317, P333+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 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 CategoriesFlam. Liq. 3 (66.7%)
Safety data
- wgk
- WGK 3
- ridadr
- 2733
- hs_code
- 2922.50.5000
- risk_code
- 11-34-43-41-37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05
- hazard_code
- Xi
- safety_code
- 16-26-36/37/39-39-36/37
- hazard_class
- IRRITANT
- Storage Class
- 11 - Combustible Solids
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H226-H314
- Hazard Classifications
- Eye Dam. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
- Precautionary statements
- P210-P233-P240-P241+P242+P243-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P370+P378-P403+P235-P405-P501
Chemistry & industry
Suppliers34 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [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]
Aladdin Scientific[email protected]
上海晶抗生物工程有限公司021-54721350 13524668266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
Related reactions
25 records
Compound notes
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