Name: 4-(HYDROXYMETHYL)PICOLINITRILE
SKU: 71935-32-5

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Basic Information

Molecular Structure:
CAS No.:	71935-32-5
Name:	4-(HYDROXYMETHYL)PICOLINITRILE
Article Data:	14

Formula:	C₇H₆N₂O
Molecular Weight:	134.137
Synonyms:	Picolinonitrile,4-(hydroxymethyl)- (7CI);2-Cyano-4-(hydroxymethyl)pyridine;4-(Hydroxymethyl)pyridine-2-carbonitrile;4-(hydroxymethyl)pyridine-2-carbonitrile;4-(Hydroxymethyl)picolinitrile;2-pyridinecarbonitrile, 4-(hydroxymethyl)-;
Density:	1.257 g/cm³
Melting Point:	111-112 °C
Boiling Point:	340.382 °C at 760 mmHg
Flash Point:	159.657 °C
PSA:	56.91000
LogP:	0.44558

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Specification

The 2-Pyridinecarbonitrile,4-(hydroxymethyl)-, with the CAS registry number 71935-32-5, has the systematic name of 4-(hydroxymethyl)pyridine-2-carbonitrile. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of this chemical is C₇H₆N₂O.

The physical properties of 2-Pyridinecarbonitrile,4-(hydroxymethyl)- are as following: (1)ACD/LogP: -0.06; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 10; (6)ACD/KOC (pH 7.4): 10; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 56.91 Å²; (11)Index of Refraction: 1.575; (12)Molar Refractivity: 35.279 cm³; (13)Molar Volume: 106.708 cm³; (14)Polarizability: 13.986×10^-24cm³; (15)Surface Tension: 65.758 dyne/cm; (16)Density: 1.257 g/cm³; (17)Flash Point: 159.657 °C; (18)Enthalpy of Vaporization: 61.63 kJ/mol; (19)Boiling Point: 340.382 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1nccc(c1)CO
(2)InChI: InChI=1/C7H6N2O/c8-4-7-3-6(5-10)1-2-9-7/h1-3,10H,5H2
(3)InChIKey: ZJSSDJCFSASGNQ-UHFFFAOYAJ