2-Methoxy-4-nitrobenzyl alcohol supplier

Name
2-Methoxy-4-nitrobenzyl alcohol
EINECS
CAS No. 136507-14-7
Article Data11
CAS DataBase
Density 1.317 g/cm³
Solubility
Melting Point
Formula C₈H₉NO₄
Boiling Point 357.4 °C at 760 mmHg
Molecular Weight 183.164
Flash Point 169.95 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzenemethanol, 2-methoxy-4-nitro-;
PSA 75.28000
LogP 1.61890

2-Methoxy-4-nitrobenzyl alcohol Specification

The 2-Methoxy-4-nitrobenzyl alcohol, with the CAS registry number of 136507-14-7, is also known as Benzenemethanol, 2-methoxy-4-nitro-. Its molecular formula is C₈H₉NO₄ and molecular weight is 152.19. What's more, its systematic name is (2-Methoxy-4-nitrophenyl)methanol.

Physical properties about the 2-Methoxy-4-nitrobenzyl alcohol are: (1)ACD/LogP: 1.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3; (6)ACD/BCF (pH 7.4): 3; (7)ACD/KOC (pH 5.5): 82; (8)ACD/KOC (pH 7.4): 82; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 75.28 Å²; (13)Index of Refraction: 1.574; (14)Molar Refractivity: 45.928 cm³; (15)Molar Volume: 139.094 cm³; (16)Surface Tension: 51.696 dyne/cm; (17)Density: 1.317 g/cm³; (18)Flash Point: 169.95 °C; (19)Enthalpy of Vaporization: 63.603 kJ/mol; (20)Boiling Point: 357.4 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: [O-][N+](=O)c1cc(OC)c(cc1)CO
(2) InChI: InChI=1/C8H9NO4/c1-13-8-4-7(9(11)12)3-2-6(8)5-10/h2-4,10H,5H2,1H3
(3) InChIKey: IWXYLEKOKGKRTN-UHFFFAOYAI

Product Name

2-Methoxy-4-nitrobenzyl alcohol

2-Methoxy-4-nitrobenzyl alcohol Specification

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