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| CAS No.: | 184950-35-4 |
|---|---|
| Name: | (Tetrahydrofuran-3-yl)methanamine hydrochloride |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C5H12ClNO |
| Molecular Weight: | 137.609 |
| Synonyms: | 1-Tetrahydrofuran-3-ylmethanamine hydrochloride; |
| EINECS: | 687-291-3 |
| Boiling Point: | 200.7 °C at 760 mmHg |
| Flash Point: | 75.2 °C |
| Hazard Symbols: | Xi |
| Risk Codes: | 37/38-41 |
| Safety: | 26-39 |
| PSA: | 35.25000 |
| LogP: | 1.48390 |
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Specification
The 3-Furanmethanamine,tetrahydro-, hydrochloride (1:1), with the CAS registry number 184950-35-4, is also known as 1-Tetrahydrofuran-3-ylmethanamine hydrochloride. It belongs to the product category of Heterocycles series. This chemical's molecular formula is C5H12ClNO and molecular weight is 137.6079. What's more, its IUPAC name is Oxolan-3-ylmethanamine hydrochloride.
Physical properties about 3-Furanmethanamine,tetrahydro-, hydrochloride (1:1) are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 35.25 Å2; (10)Flash Point: 75.2 °C; (11)Enthalpy of Vaporization: 44.59 kJ/mol; (12)Boiling Point: 200.7 °C at 760 mmHg; (13)Vapour Pressure: 0.268 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Cl.NCC1CCOC1
(2) InChI: InChI=1/C5H11NO.ClH/c6-3-5-1-2-7-4-5;/h5H,1-4,6H2;1H
(3) InChIKey: LZHYUVOFRJAJKS-UHFFFAOYAR