CAS No.35255-58-4,(chloromethyl)naphthalene Suppliers

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Basic Information

Molecular Structure:
CAS No.:	35255-58-4
Name:	(chloromethyl)naphthalene

Formula:	C₁₁H₉Cl
Molecular Weight:	176.6422
Synonyms:	(Chloromethyl)naphthalene;1-(chloromethyl)naphthalene;1-(Chlormethyl)naphthalen;Naphthalene, (chloromethyl)-;Naphthalene, 1- (chloromethyl)-;α-(Chloromethyl)naphthalene;Naphthalene, α-(chloromethyl)-;
EINECS:	252-469-8
Density:	1.167 g/cm³
Boiling Point:	291.5 °C at 760 mmHg
Flash Point:	129.9 °C
Appearance:	clear to light yellow liquid
PSA:	0.00000
LogP:	3.25500

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Specification

The Naphthalene,(chloromethyl)-, with the CAS registry number 35255-58-4 and EINECS registry number 252-469-8, has the systematic name and IUPAC name of 1-(chloromethyl)naphthalene. And the molecular formula of the chemical is C₁₁H₉Cl.

The characteristics of Naphthalene,(chloromethyl)- are as followings: (1)ACD/LogP: 3.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.72; (4)ACD/LogD (pH 7.4): 3.72; (5)ACD/BCF (pH 5.5): 393.89; (6)ACD/BCF (pH 7.4): 393.89; (7)ACD/KOC (pH 5.5): 2508.26; (8)ACD/KOC (pH 7.4): 2508.26; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.63; (14)Molar Refractivity: 53.86 cm³; (15)Molar Volume: 151.2 cm³; (16)Polarizability: 21.35×10^-24cm³; (17)Surface Tension: 42.5 dyne/cm; (18)Density: 1.167 g/cm³; (19)Flash Point: 129.9 °C; (20)Enthalpy of Vaporization: 50.97 kJ/mol; (21)Boiling Point: 291.5 °C at 760 mmHg; (22)Vapour Pressure: 0.00339 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: ClCc2cccc1ccccc12
(2)InChI: InChI=1/C11H9Cl/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2
(3)InChIKey: XMWGTKZEDLCVIG-UHFFFAOYAP