Basic information
- CAS
165253-31-6- Standard SMILES
NCC1CCOC1- InChIKey
CINJIXGRSTYIHP-UHFFFAOYSA-N- Molecular formula
- C5H11NO
- Average molar mass
- 101.15 g/mol
- Monoisotopic mass
- 101.08406397
Names & identifiers
- Preferred name
- (Tetrahydrofuran-3-yl)methanamine
- IUPAC
- oxolan-3-ylmethanamine
- English name
- Tetrahydrofuran-3-yl)methanamine
- Molecular formula
- C5H11NO
- Molecular weight
- 101.15
Names & synonyms
(tetrahydrofuran-3-yl)methanamineDTXSID30447520RefChem:408477DTXCID30398341165253-31-6Oxolan-3-ylmethanamine3-furanmethanamine, tetrahydro-1-tetrahydrofuran-3-ylmethanamine3-(Aminomethyl)tetrahydrofuranc-(tetrahydro-furan-3-yl)-methylamineTETRAHYDRO-3-FURANMETHANAMINEMFCD08234925
Show more names
3-Aminomethyltetrahydrofuran3-Aminomethyl-THFoxolan-3-ylmethylamine3-Tetrahydro-furanmethanamine3-FuranMethanaMine,tetrahydro-(Tetrahydrofur-3-yl)methylamine
tetrahydrofuran-3-ylmethylamineC-(Tetrahydrofuran-3-yl)methylamine(oxolan-3-yl)methanamine(tetrahydrofuran-3-yl)methylamine(R)-Tetrahydrofuran-3-methanamine(S)-Tetrahydrofuran-3-methanamine[(3R)-Tetrahydrofuran-3-yl]methanamine1-(OXOLAN-3-YL)METHANAMINE
Database identifiers
- CAS
165253-31-6- PubChem CID
- 10898660
- DTXSID
DTXSID30447520- Nikkaji
- J1.801.509I
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 56
Physicochemical properties
- Boiling point
- 156 · 156.0±13.0℃ (760 Torr)
- Density
- 0.967 · 0.967±0.06 g/cm3 (20 ºC 760 Torr)
- refractive index
- 20 · n20/D1.462
- Flash point
- 53.1 · 53.1±13.1℃
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solution
- pka
- 9.96 · 9.96±0.29(Predicted)
- color
- Clear colorless
- InChI
- InChI=1S/C5H11NO/c6-3-5-1-2-7-4-5/h5H,1-4,6H2
- InChIKey
- CINJIXGRSTYIHP-UHFFFAOYSA-N
- SMILES
- O1CCC(CN)C1
- CAS DataBase Reference
- 165253 · 165253-31-6
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS07
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- ridadr
- 1993
- hs_code
- 29321900
- risk_code
- 10-37/38-41
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS07
- hazard_code
- Xi
- safety_code
- 26-37/39
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- Ⅲ
- target organs
- Respiratory system
- Hazard statements
- H226-H315-H318-H335
- REACH Registrations
- Active
- Hazard Classifications
- Eye Dam. 1Flam. Liq. 3Skin Irrit. 2STOT SE 3
- Precautionary statements
- P210-P233-P240-P280-P303+P361+P353-P305+P351+P338
Chemistry & industry
Applications
UsesTetrahydrofuran-3-yl)methanamine is an intermediate in the synthesis of Dinoteturan(D482100), a neonicotinoid insecticide.
Upstream & downstream products
Upstream raw materials
Suppliers100 total
常州帝通化工有限公司+86-0519-88298848 · [email protected]
杭州创引化工科技有限公司0571-87086220 13516718938 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]
上海策嵘生物科技有限公司[email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Related reactions
21 records
Compound notes
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