CAS No.16274-33-2,2,2-Dimethyl-3,4-dihydro-2H-naphtho[1,2-b]pyran Suppliers

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Basic Information

Molecular Structure:
CAS No.:	16274-33-2
Name:	2,2-Dimethyl-3,4-dihydro-2H-naphtho[1,2-b]pyran
Article Data:	3

Formula:	C₁₅H₁₆O
Molecular Weight:	212.291
Synonyms:	2,2-Dimethyl-3,4-dihydro-2H-benzo[h]chromene;
Density:	1.062 g/cm³
Boiling Point:	334.682 °C at 760 mmHg
Flash Point:	152.634 °C
PSA:	9.23000
LogP:	3.94340

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Specification

The 3,4-Dihydro-2,2-dimethyl-2H-naphtho[1,2-b]pyran, with the CAS registry number 16274-33-2, is also known as 2,2-Dimethyl-3,4-dihydro-2H-naphtho[1,2-b]pyran. This chemical's molecular formula is C₁₅H₁₆O and molecular weight is 212.12. What's more, its systematic name is called 2,2-Dimethyl-3,4-dihydro-2H-benzo[h]chromene.

Physical properties about 3,4-Dihydro-2,2-dimethyl-2H-naphtho[1,2-b]pyran are: (1)ACD/LogP: 4.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 5; (4)ACD/LogD (pH 7.4): 5; (5)ACD/BCF (pH 5.5): 4901; (6)ACD/BCF (pH 7.4): 4901; (7)ACD/KOC (pH 5.5): 15244; (8)ACD/KOC (pH 7.4): 15244; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.587; (14)Molar Refractivity: 67.196 cm³; (15)Molar Volume: 199.836 cm³; (16)Surface Tension: 40.777 dyne/cm; (17)Density: 1.062 g/cm³; (18)Flash Point: 152.634 °C; (19)Enthalpy of Vaporization: 55.476 kJ/mol; (20)Boiling Point: 334.682 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O3c2c1ccccc1ccc2CCC3(C)C
(2) InChI: InChI=1/C15H16O/c1-15(2)10-9-12-8-7-11-5-3-4-6-13(11)14(12)16-15/h3-8H,9-10H2,1-2H3
(3) InChIKey: HYUYQZUDUFSJRS-UHFFFAOYAN