3-Chloro-2-methoxybenzaldehyde supplier

Name
3-CHLORO-2-METHOXYBENZALDEHYDE
EINECS
CAS No. 223778-54-9
Article Data1
CAS DataBase
Density 1.244 g/cm³
Solubility
Melting Point
Formula C₈H₇ClO₂
Boiling Point 261.1 °C at 760 mmHg
Molecular Weight 170.595
Flash Point 116 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Chloro-2-methoxybenzaldehyde;
PSA 26.30000
LogP 2.16110

3-Chloro-2-methoxybenzaldehyde Specification

The 3-Chloro-2-methoxybenzaldehyde, with the CAS registry number 223778-54-9, is also known as Benzaldehyde, 3-chloro-2-methoxy-. This chemical's molecular formula is C₈H₇ClO₂ and molecular weight is 170.59. Its systematic name is called 3-Chloro-2-methoxybenzaldehyde.

Physical properties of 3-Chloro-2-methoxybenzaldehyde: (1)ACD/LogP: 2.28; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.28; (4)ACD/LogD (pH 7.4): 2.28; (5)ACD/BCF (pH 5.5): 31.85; (6)ACD/BCF (pH 7.4): 31.85; (7)ACD/KOC (pH 5.5): 414.51; (8)ACD/KOC (pH 7.4): 414.51; (9)#H bond acceptors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.564; (12)Molar Refractivity: 44.57 cm³; (13)Molar Volume: 137 cm³; (14)Surface Tension: 40 dyne/cm; (15)Density: 1.244 g/cm³; (16)Flash Point: 116 °C; (17)Enthalpy of Vaporization: 49.88 kJ/mol; (18)Boiling Point: 261.1 °C at 760 mmHg; (19)Vapour Pressure: 0.0118 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1c(cccc1Cl)C=O
(2)InChI: InChI=1/C8H7ClO2/c1-11-8-6(5-10)3-2-4-7(8)9/h2-5H,1H3
(3)InChIKey: KAVGGMKKDUTMJP-UHFFFAOYAW

Product Name

3-CHLORO-2-METHOXYBENZALDEHYDE

3-Chloro-2-methoxybenzaldehyde Specification

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