Propanol, 1(or2)-(2-methoxymethylethoxy)-, acetate (88917-22-0)

The IUPAC name of Dipropyleneglycol methyl ether acetate is 1-(3-methoxypropoxy)propyl acetate. With the CAS registry number 88917-22-0, it is also named as Propanol, 1(or 2)-(2-methoxymethylethoxy)-, acetate. The product's categories are C8 to C9; Carbonyl Compounds; Esters. It is colorless, transparent, low toxicity and flammable liquid with a slight ether odor. And it has good solubility to most resins, such as acrylic resin, epoxy resin, alkyd resin and polyester resin. Additionally, this chemical should be sealed in the container and stored in the cool and dry place. Besides, it is used as solvent-based coating and screen printing ink.

The other characteristics of Dipropyleneglycol methyl ether acetate can be summarized as: (1)ACD/LogP: 1.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.12; (4)ACD/LogD (pH 7.4): 1.12; (5)ACD/BCF (pH 5.5): 4.21; (6)ACD/BCF (pH 7.4): 4.21; (7)ACD/KOC (pH 5.5): 97.42; (8)ACD/KOC (pH 7.4): 97.42; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Index of Refraction: 1.419; (13)Molar Refractivity: 48.96 cm³; (14)Molar Volume: 193.6 cm³; (15)Polarizability: 19.41×10^-24 cm³; (16)Surface Tension: 29.5 dyne/cm; (17)Enthalpy of Vaporization: 46.71 kJ/mol; (18)Vapour Pressure: 0.0657 mmHg at 25°C; (19)Rotatable Bond Count: 8; (20)Exact Mass: 190.120509; (21)MonoIsotopic Mass: 190.120509; (22)Topological Polar Surface Area: 44.8; (23)Heavy Atom Count: 13; (24)Complexity: 136.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing.

People can use the following data to convert to the molecule structure.
1. SMILES:O=C(OC(OCCCOC)CC)C
2. InChI:InChI=1/C9H18O4/c1-4-9(13-8(2)10)12-7-5-6-11-3/h9H,4-7H2,1-3H3 
3. InChIKey:USDXBNSCKZJDLC-UHFFFAOYAT
4. Std. InChI:InChI=1S/C9H18O4/c1-4-9(13-8(2)10)12-7-5-6-11-3/h9H,4-7H2,1-3H3 
5. Std. InChIKey:USDXBNSCKZJDLC-UHFFFAOYSA-N