(S)-Morpholin-3-ylmethanol hydrochloride supplier

Name
(S)-3-Hydroxymethylmorpholine hydrochloride
EINECS
CAS No. 218594-79-7
Article Data3
CAS DataBase
Density 1.045 g/cm³
Solubility
Melting Point
Formula C₅H₁₁NO₂
Boiling Point 218.3 °C at 760 mmHg
Molecular Weight 153.609
Flash Point 85.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (3S)-Morpholin-3-ylmethanol;(S)-3-Hydroxymethylmorpholine;AC1LTT73;H30270;CID1514268;
PSA 41.49000
LogP 0.09790

(S)-Morpholin-3-ylmethanol hydrochloride Specification

The (S)-Morpholin-3-ylmethanol with CAS registry number of 218594-79-7 is also known as (S)-3-Hydroxymethylmorpholine. The IUPAC name is [(3S)-Morpholin-3-yl]methanol. It belongs to product categories of Pharmacetical. In addition, the formula is C₅H₁₁NO₂ and the molecular weight is 117.15.

Physical properties about (S)-Morpholin-3-ylmethanol are: (1)ACD/LogP: -1.82; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.4; (4)ACD/LogD (pH 7.4): -2.71; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 21.7Å²; (13)Index of Refraction: 1.441; (14)Molar Refractivity: 29.62 cm³; (15)Molar Volume: 112.1 cm³; (16)Polarizability: 11.74×10^-24cm³; (17)Surface Tension: 38.1 dyne/cm; (18)Density: 1.045 g/cm³; (19)Flash Point: 85.9 °C; (20)Enthalpy of Vaporization: 52.88 kJ/mol; (21)Boiling Point: 218.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0268 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: OC[C@@H]1NCCOC1
2. InChI: InChI=1/C5H11NO2/c7-3-5-4-8-2-1-6-5/h5-7H,1-4H2/t5-/m0/s1
3. InChIKey: UCDFBOLUCCNTDQ-YFKPBYRVBG
4. Std. InChI: InChI=1S/C5H11NO2/c7-3-5-4-8-2-1-6-5/h5-7H,1-4H2/t5-/m0/s1
5. Std. InChIKey: UCDFBOLUCCNTDQ-YFKPBYRVSA-N

Product Name

(S)-3-Hydroxymethylmorpholine hydrochloride

(S)-Morpholin-3-ylmethanol hydrochloride Specification

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