Benzaldehyde,3-(3-bromopropoxy)- supplier

Name
3-(3-BROMOPROPOXY)BENZALDEHYDE
EINECS
CAS No. 144707-69-7
Article Data10
CAS DataBase
Density 1.419 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₁BrO₂
Boiling Point 343.478 °C at 760 mmHg
Molecular Weight 243.1
Flash Point 161.53 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-(3-Bromopropyloxy)benzaldehyde;3-(3-Bromopropoxy)benzaldehyde;
PSA 26.30000
LogP 2.66290

Benzaldehyde,3-(3-bromopropoxy)- Specification

The CAS registry number of Benzaldehyde,3-(3-bromopropoxy)- is 144707-69-7. This chemical's molecular formula is C₁₀H₁₁BrO₂ and molecular weight is 243.1. What's more, its systematic name is called 3-(3-Bromopropoxy)benzaldehyde.

Physical properties about Benzaldehyde,3-(3-bromopropoxy)- are: (1)ACD/LogP: 2.82; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 80; (6)ACD/BCF (pH 7.4): 80; (7)ACD/KOC (pH 5.5): 798; (8)ACD/KOC (pH 7.4): 798; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.576; (14)Molar Refractivity: 56.682 cm³; (15)Molar Volume: 171.297 cm³; (16)Polarizability: 22.47×10^-24 cm³; (17)Surface Tension: 43.814 dyne/cm; (18)Density: 1.419 g/cm³; (19)Flash Point: 161.53 °C; (20)Enthalpy of Vaporization: 58.734 kJ/mol; (21)Boiling Point: 343.478 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=Cc1cc(OCCCBr)ccc1
(2) InChI: InChI=1/C10H11BrO2/c11-5-2-6-13-10-4-1-3-9(7-10)8-12/h1,3-4,7-8H,2,5-6H2
(3) InChIKey: AQVYBJOWJVFFBA-UHFFFAOYAJ

Product Name

3-(3-BROMOPROPOXY)BENZALDEHYDE

Benzaldehyde,3-(3-bromopropoxy)- Specification

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