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CAS No.: | 70161-44-3 |
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Name: | Sodium hydroxymethylglycinate |
Molecular Structure: | |
Formula: | C3H7NO3.Na |
Molecular Weight: | 128.08 |
Synonyms: | Glycine,N-(hydroxymethyl)-, monosodium salt (9CI);Integra 44;Sodium(hydroxymethyl)glycinate;Suttocide A; |
EINECS: | 274-357-8 |
Density: | 1.653[at 20℃] |
Boiling Point: | 307.2 °C at 760 mmHg |
Flash Point: | 139.6 °C |
Solubility: | 500g/L at 20℃ |
Appearance: | colorless to light yellow transparent liquid |
Hazard Symbols: | Xn |
Risk Codes: | 22-36 |
Safety: | 26 |
PSA: | 72.39000 |
LogP: | -2.33340 |
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This chemical is called Sodium hydroxymethyl glycinate, and its systematic name is Glycine, N-(hydroxymethyl)-, monosodium salt. With the molecular formula of C3H7NO3.Na, its molecular weight is 128.08. The CAS registry number of this chemical is 70161-44-3, and its product category is pharmacetical. In addition, this chemical is colorless to light yellow transparent liquid, and it's very stable in the solution which pH is 3~12.
Other characteristics of the Sodium hydroxymethyl glycinate can be summarised as followings: (1)ACD/LogP: -1.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3; (4)ACD/LogD (pH 7.4): -4; (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: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 49.77 Å2; (13)Flash Point: 139.6 °C; (14)Enthalpy of Vaporization: 63.52 kJ/mol; (15)Boiling Point: 307.2 °C at 760 mmHg; (16)Vapour Pressure: 6.8E-05 mmHg at 25°C.
Uses of this chemical: The Sodium hydroxymethyl glycinate is often used as preservative for inhibition of Gram-positive bacteria, Gram-negative bacteria, yeast and mold. It can also be used as cleaning products.
You can still convert the following datas into molecular structure:
1.SMILES: [Na+].[O-]C(=O)CNCO
2.InChI: InChI=1/C3H7NO3.Na/c5-2-4-1-3(6)7;/h4-5H,1-2H2,(H,6,7);/q;+1/p-1
3.InChIKey: CITBNDNUEPMTFC-REWHXWOFAZ