Basic information
- Name:
1,4-Oxazepine,hexahydro-, hydrochloride (1:1)
- Superlist Name:
- Homomorpholine hydrochloride
- CAS No.:
178312-62-4
- Molecular Structure:
- Formula:
- C5H11NO.HCl
- Molecular Weight:
- 137.61
- Synonyms:
- 1,4-Oxazepine,hexahydro-, hydrochloride (9CI);1,4-Oxazepan hydrochloride;Hexahydro-1,4-oxazepine hydrochloride;
- Melting Point:
- 156-154 °C
- Boiling Point:
- 196.9 °C at 760 mmHg
- Flash Point:
- 72.9 °C
- Risk Codes:
- 10-20/21-34-65
- Safety Description:
- 16-26-36/37/39 Details
- Transport Information:
- UN 2921
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Specification
The Homomorpholine hydrochloride with CAS registry number of 178312-62-4 is also known as 1,4-Ooxazepine, hexahydro-, hydrochloride (1:1). The IUPAC name is 1,4-Oxazepane hydrochloride. In addition, the formula is C5H11NO.HCl and the molecular weight is 137.61. This chemical is a shallow brown powder and should be stored in sealed containers in ventilated, cool, and dry place.
Physical properties about Homomorpholine hydrochloride are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1; (4)ACD/KOC (pH 7.4): 1; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 21.26Å2; (9)Flash Point: 72.9 °C; (10)Enthalpy of Vaporization: 44.2 kJ/mol; (11)Boiling Point: 196.9 °C at 760 mmHg; (12)Vapour Pressure: 0.328 mmHg at 25 °C.
When you are using this chemical, please be cautious about it. As a chemical, it is flammable that may cause burns. Besides, this chemical is harmful by inhalation and in contact with skin. During using it, wear suitable protective clothing, gloves and eye/face protection. Keep away from sources of ignition. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1. SMILES: Cl.C1CCNCCO1
2. InChI:InChI=1/C5H11NO.ClH/c1-2-6-3-5-7-4-1;/h6H,1-5H2;1H
3. InChIKey: LJRCWNIWOVZLKS-UHFFFAOYAI
4. Std. InChI: InChI=1S/C5H11NO.ClH/c1-2-6-3-5-7-4-1;/h6H,1-5H2;1H
5. Std. InChIKey: LJRCWNIWOVZLKS-UHFFFAOYSA-N