CAS No.412030-10-5,1H-Pyrrolo[2,3-c]pyridine,2,3-dihydro-5-methoxy-(9CI) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	412030-10-5
Name:	1H-Pyrrolo[2,3-c]pyridine,2,3-dihydro-5-methoxy-(9CI)
Article Data:	3

Formula:	C₈H₁₀N₂O
Molecular Weight:	150.18
Synonyms:	5-Methoxy-2,3-dihydro-1H-pyrrolo[2,3-c]pyridine;
Density:	1.14 g/cm³
Boiling Point:	268.369 °C at 760 mmHg
Flash Point:	116.106 °C
PSA:	34.15000
LogP:	1.19620

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Specification

The 1H-Pyrrolo[2,3-c]pyridine,2,3-dihydro-5-methoxy-, with the CAS registry number 412030-10-5, belongs to the product categories of Pyridine; Methoxy; Pyrrolidine. This chemical's molecular formula is C₈H₁₀N₂O and molecular weight is 150.1778. What's more, its systematic name is called 5-Methoxy-2,3-dihydro-1H-pyrrolo[2,3-c]pyridine.

Physical properties about 1H-Pyrrolo[2,3-c]pyridine,2,3-dihydro-5-methoxy- are: (1)ACD/LogP: 0.96; (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): 2; (6)ACD/BCF (pH 7.4): 3; (7)ACD/KOC (pH 5.5): 57; (8)ACD/KOC (pH 7.4): 79; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 34.15 Å²; (13)Index of Refraction: 1.549; (14)Molar Refractivity: 41.933 cm³; (15)Molar Volume: 131.784 cm³; (16)Polarizability: 16.624×10^-24cm³; (17)Surface Tension: 42.808 dyne/cm; (18)Density: 1.14 g/cm³; (19)Flash Point: 116.106 °C; (20)Enthalpy of Vaporization: 50.644 kJ/mol; (21)Boiling Point: 268.369 °C at 760 mmHg; (22)Vapour Pressure: 0.008 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: COc1cc2c(cn1)NCC2
(2) InChI: InChI=1/C8H10N2O/c1-11-8-4-6-2-3-9-7(6)5-10-8/h4-5,9H,2-3H2,1H3
(3) InChIKey: WJFXVTBMJUVLAX-UHFFFAOYAX