1-(3-Chloropropoxy)-3-nitrobenzene supplier

Name
1-(3-Chloropropoxy)-3-nitrobenzene
EINECS
CAS No. 132636-13-6
Article Data5
CAS DataBase
Density 1.271 g/cm³
Solubility
Melting Point
Formula C₉H₁₀ClNO₃
Boiling Point 349.415 °C at 760 mmHg
Molecular Weight 215.636
Flash Point 165.12 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-(3-chloropropoxy)-3-nitrobenzene;UKRORGSYN-BB BBV-022721
PSA 55.05000
LogP 3.12570

1-(3-Chloropropoxy)-3-nitrobenzene Specification

The Benzene, 1-(3-chloropropoxy)-3-nitro- has the CAS registry number 132636-13-6. This chemical's molecular formula is C₉H₁₀ClNO₃ and molecular weight is 215.63. What's more, its systematic name is 1-(3-chloropropoxy)-3-nitrobenzene.

Physical properties of Benzene, 1-(3-chloropropoxy)-3-nitro- are: (1)ACD/LogP: 3.35; (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): 126; (6)ACD/BCF (pH 7.4): 126; (7)ACD/KOC (pH 5.5): 1110; (8)ACD/KOC (pH 7.4): 1110; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 55.05 Å²; (13)Index of Refraction: 1.544; (14)Molar Refractivity: 53.592 cm³; (15)Molar Volume: 169.676 cm³; (16)Polarizability: 21.245×10^-24cm³; (17)Surface Tension: 44.176 dyne/cm; (18)Density: 1.271 g/cm³; (19)Flash Point: 165.12 °C; (20)Enthalpy of Vaporization: 57.045 kJ/mol; (21)Boiling Point: 349.415 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cccc(OCCCCl)c1
(2)InChI: InChI=1S/C9H10ClNO3/c10-5-2-6-14-9-4-1-3-8(7-9)11(12)13/h1,3-4,7H,2,5-6H2
(3)InChIKey: TUVHZIRZPUPODN-UHFFFAOYSA-N

Product Name

1-(3-Chloropropoxy)-3-nitrobenzene

1-(3-Chloropropoxy)-3-nitrobenzene Specification

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