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CAS No.: | 7544-75-4 |
---|---|
Name: | 2-Amino-1-pyrroline hydrochloride |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C4H9ClN2 |
Molecular Weight: | 120.582 |
Synonyms: | 2H-Pyrrol-5-amine,3,4-dihydro-, monohydrochloride (9CI);Pyrrolidine, 2-imino-, monohydrochloride(8CI);2-Iminopyrrolidine hydrochloride;3,4-dihydro-2H-pyrrol-5-amine hydrochloride (1:1);2-Amino-1-pyrroline hydrochloride; |
Melting Point: | 171.0 to 175.0 °C |
Boiling Point: | 211 °C at 760 mmHg |
Flash Point: | 81.4 °C |
PSA: | 38.38000 |
LogP: | 1.07530 |
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The 2-Amino-1-pyrroline hydrochloride, with the CAS registry number 7544-75-4, is also known as 2-Amino-1-pyrroline hydrochloride. This chemical's molecular formula is C4H9ClN2 and molecular weight is 120.58. What's more, its systematic name is 3,4-dihydro-2H-pyrrol-5-amine hydrochloride (1:1).
Physical properties of 2-Amino-1-pyrroline hydrochloride 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: 0; (9)Polar Surface Area: 38.38 Å2; (10)Flash Point: 81.4 °C; (11)Enthalpy of Vaporization: 45.64 kJ/mol; (12)Boiling Point: 211 °C at 760 mmHg; (13)Vapour Pressure: 0.155 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: Cl.NC=1CCCN=1
(2)InChI: InChI=1/C4H8N2.ClH/c5-4-2-1-3-6-4;/h1-3H2,(H2,5,6);1H
(3)InChIKey: JEBHLIYFPKISBI-UHFFFAOYAE