Basic information
- CAS
104530-79-2- Standard SMILES
NC1CCOC1- InChIKey
MIPHRQMEIYLZFZ-UHFFFAOYSA-N- Molecular formula
- C4H9NO
- Average molar mass
- 87.12 g/mol
- Monoisotopic mass
- 87.06841391
Names & identifiers
- Preferred name
- Oxolan-3-amine
- IUPAC
- oxolan-3-amine
- English name
- (S)-3-AMINOTETRAHYDROFURAN
- Molecular formula
- C4H9NO
- Molecular weight
- 87.12
Names & synonyms
88675-24-5Oxolan-3-amineDTXSID00909029RefChem:857782DTXCID90863424685-688-63-Aminotetrahydrofurantetrahydrofuran-3-amineTetrahydro-furan-3-ylamine3-amino-tetrahydrofuranMFCD0777839445379-55-3
Show more names
(S)-TETRAHYDROFURAN-3-AMINE(3S)-oxolan-3-aMine(3S)-oxolan-3-amine TsOH salt(S)-3-Aminotetrahydrofuran tosylate(S)-3-AMINOTETRAHYDROFURAN(3S)-Tetrahydro-3-furanamine(S)-3-AMinotetrahydrofura...(S)-Tetrahydro-furan-3-ylamine(S)-Tetrahydrofuran-3-amine 98%(S)-TETRAHYDROFURAN-3-AMINE HCL
tetrahydrofuran-3-ylaminerac-3-aminotetrahydrofuranPB10514PB18852PB27801SB10060EN300-98749Z802544198
Database identifiers
- CAS
104530-79-2、88675-24-5- PubChem CID
- 3365553
- DTXSID
DTXSID00909029- EC Number
- 685-688-6
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 46.8
Physicochemical properties
- Boiling point
- 125.6 · 125.6±33.0 °C(Predicted)
- Density
- 0.997 · 0.997±0.06 g/cm3(Predicted)
- storage temp.
- 0 · Store at 0-8 °C
- solubility
- Methanol: Slightly soluble
- form
- Crystalline Powder or Flakes
- pka
- 8.9 · 8.90±0.20(Predicted)
- color
- Off-white to brown
- InChI
- InChI=1S/C4H9NO/c5-4-1-2-6-3-4/h4H,1-3,5H2/t4-/m0/s1
- InChIKey
- MIPHRQMEIYLZFZ-BYPYZUCNSA-N
- SMILES
- O1CC[C@H](N)C1
- CAS DataBase Reference
- 104530 · 104530-79-2
- Symbol(GHS)
- 2 · GHS02,GHS05
- Signal word
- Danger
- Hazard statements
- 226 · H226-H314-H318
- Precautionary statements
- 210 · P210-P233-P240-P241-P242-P243-P260-P264-P280-P301+P310+P330+P331-P303+P361+P353+P310-P304+P340+P310-P305+P351+P338+P310-P363-P370+P378-P403+P235-P405-P501
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
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P280, P301+P317, P302+P352, P303+P361+P353, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 42 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 (100%)
Safety data
- ridadr
- UN1993
- hs_code
- 2932190090
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05
- Hazard statements
- H226-H314-H318
- Precautionary statements
- P210-P233-P240-P241-P242-P243-P260-P264-P280-P301+P310+P330+P331-P303+P361+P353+P310-P304+P340+P310-P305+P351+P338+P310-P363-P370+P378-P403+P235-P405-P501
Chemistry & industry
Applications
Uses(S)-Tetrahydrofuran-3-ylamine (3-Aminotetrahydrofuran) is a synthetic intermediate useful for pharmaceutical synthesis.
Suppliers100 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]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [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]
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]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
重庆张邦医药科技有限责任公司028-84252981 18583719936 · [email protected]
常州琬瑶生物科技有限公司051989185693 15312551983 · [email protected]
Advanced chemblocks inc650-6922368 650-6922368;650-6922368 · [email protected]
Related reactions
75 records
Compound notes
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