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3-benzyloxy-1-propanol (4799-68-2)

Identification
Name:3-benzyloxy-1-propanol
Synonyms:1-Propanol,3-(benzyloxy)- (6CI,7CI,8CI); 1,3-Propanediol monobenzyl ether;1-(Benzyloxy)-3-propanol; 3-(Benzyloxy)-1-propanol; 3-(Phenylmethoxy)-1-propanol;3-Benzyloxypropanol; 3-[(Phenylmethyl)oxy]propan-1-ol; NSC 406922
CAS:4799-68-2
Molecular Formula: C10H14O2
Molecular Weight: 166.22
InChI: InChI=1/C10H14O2/c11-7-4-8-12-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2
Molecular Structure: (C10H14O2) 1-Propanol,3-(benzyloxy)- (6CI,7CI,8CI); 1,3-Propanediol monobenzyl ether;1-(Benzyloxy)-3-propanol; ...
Properties
Melting Point: 38
Density:1.049
Refractive index:n20/D 1.516
Solubility:3.7 g/L (25 C)
Appearance:Colorless viscous liquid
Specification:

The IUPAC name of 1-Propanol,3-(phenylmethoxy)- is 3-phenylmethoxypropan-1-ol. With the CAS registry number 4799-68-2, it is also named as 3-(Benzyloxy)propan-1-ol. The product's categories are alcohols; anisoles, alkyloxy compounds & phenylacetates; oxygen compounds. In addition, it is colorless viscous liquid which is used as pharmaceutical intermediate.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 1.67; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 6; (6)Index of Refraction: 1.519; (7)Molar Refractivity: 48.34 cm3; (8)Molar Volume: 159.1 cm3; (9)Polarizability: 19.16×10-24 cm3; (10)Surface Tension: 39.8 dyne/cm; (11)Enthalpy of Vaporization: 54.16 kJ/mol; (12)Vapour Pressure: 0.00264 mmHg at 25°C; (13)Rotatable Bond Count: 5; (14)Exact Mass: 166.09938; (15)MonoIsotopic Mass: 166.09938; (16)Topological Polar Surface Area: 29.5; (17)Heavy Atom Count: 12; (18)Complexity: 98.

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 imedical advice. If you want to contact this product, you must wear suitable gloves and eye/face protection. 

People can use the following data to convert to the molecule structure. 
1. SMILES: O(CCCO)Cc1ccccc1;
2. InChI: InChI=1/C10H14O2/c11-7-4-8-12-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2.

Storage Temperature: Keep tightly closed. Store in a cool dry place.
Safety Data
Hazard Symbols Xi:Irritant