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4-[3-(Dimethylamino)propoxy]benzaldehyde

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Name

4-[3-(Dimethylamino)propoxy]benzaldehyde

EINECS N/A
CAS No. 26934-35-0 Density 1.044g/cm3
PSA 29.54000 LogP 1.82960
Solubility N/A Melting Point N/A
Formula C12H17 N O2 Boiling Point 325.4 °C at 760 mmHg
Molecular Weight 207.272 Flash Point 150.6 °C
Transport Information N/A Appearance N/A
Safety
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-37/39
WGK Germany 3
Risk Codes R36/37/38   
Molecular Structure Molecular Structure of 26934-35-0 (4-[3-(Dimethylamino)propoxy]benzaldehyde) Hazard Symbols IrritantXi
Synonyms

Benzaldehyde,p-[3-(dimethylamino)propoxy]- (6CI,7CI,8CI);4-(3-Dimethylaminopropoxy)benzaldehyde;

Article Data 16

4-[3-(Dimethylamino)propoxy]benzaldehyde Specification

The 4-[3-(Dimethylamino)propoxy]benzaldehyde with cas registry number of 26934-35-0, is also called Benzaldehyde,p-[3-(dimethylamino)propoxy]- (6CI,7CI,8CI) .The 4-[3-(Dimethylamino)propoxy]benzaldehyde belongs to the following product categories: (1)Aldehydes; (2)C10 to C21; (3)Carbonyl Compounds .

Physical properties of 4-[3-(Dimethylamino)propoxy]benzaldehyde : (1)ACD/LogP: 1.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.4; (4)ACD/LogD (pH 7.4): -0.25; (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): 2.44; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.536; (14)Molar Refractivity: 61.93 cm3; (15)Molar Volume: 198.3 cm3; (16)Polarizability: 24.55×10-24cm3; (17)Surface Tension: 38.3 dyne/cm; (18)Enthalpy of Vaporization: 56.76 kJ/mol; (19)Vapour Pressure: 0.00023 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: 
The 4-[3-(Dimethylamino)propoxy]benzaldehyde irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If 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:O=Cc1ccc(OCCCN(C)C)cc1; (2)InChI:InChI=1/C12H17NO2/c1-13(2)8-3-9-15-12-6-4-11(10-14)5-7-12/h4-7,10H,3,8-9H2,1-2H3; (3)InChIKey:ZYOHTXKOHWSJMZ-UHFFFAOYAY; (4)Std. InChI:InChI=1S/C12H17NO2/c1-13(2)8-3-9-15-12-6-4-11(10-14)5-7-12/h4-7,10H,3,8-9H2,1-2H3; (5)Std. InChIKey:ZYOHTXKOHWSJMZ-UHFFFAOYSA-N.

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