CAS No.6398-87-4,3-(1,3-Dioxolan-2-yl)aniline Suppliers

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Basic Information

Molecular Structure:
CAS No.:	6398-87-4
Name:	3-(1,3-Dioxolan-2-yl)aniline
Article Data:	20

Formula:	C₉H₁₁NO₂
Molecular Weight:	165.192
Synonyms:	Aniline,m-1,3-dioxolan-2-yl- (7CI,8CI);2-(3-Aminophenyl)-1,3-dioxolane;3-(1,3-Dioxolan-2-yl)aniline;3-(1,3-Dioxolan-2-yl)phenylamine;
Density:	1.203 g/cm³
Boiling Point:	313.9 °C at 760 mmHg
Flash Point:	156.9 °C
Hazard Symbols:	Xn
Risk Codes:	20/21/22-36/37/38
Safety:	26-36/37/39
PSA:	44.48000
LogP:	1.89540

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Specification

The CAS register number of 3-(1,3-Dioxolan-2-yl)aniline is 6398-87-4. It also can be called as Benzenamine,3-(1,3-dioxolan-2-yl)- and the systematic name about this chemical is 3-(1,3-dioxolan-2-yl)aniline. The molecular formula about this chemical is C₉H₁₁NO₂and the molecular weight is 165.19. It belongs to the following product categories, such as Amines; Phenyls & Phenyl-Het; Phenyls & Phenyl-Het and so on.

Physical properties about 3-(1,3-Dioxolan-2-yl)aniline are: (1)ACD/LogP: 0.35; (2)ACD/LogD (pH 5.5): 0.31; (3)ACD/LogD (pH 7.4): 0.34; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1.08; (6)ACD/KOC (pH 5.5): 33.95; (7)ACD/KOC (pH 7.4): 36.67; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 21.7Å²; (12)Index of Refraction: 1.58; (13)Molar Refractivity: 45.72 cm³; (14)Molar Volume: 137.2 cm³; (15)Polarizability: 18.12x10^-24cm³; (16)Surface Tension: 51.9 dyne/cm; (17)Enthalpy of Vaporization: 55.5 kJ/mol; (18)Boiling Point: 313.9 °C at 760 mmHg; (19)Vapour Pressure: 0.000482 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed and it is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O1CCOC1c2cc(ccc2)N
(2)InChI: InChI=1/C9H11NO2/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-3,6,9H,4-5,10H2
(3)InChIKey: SPLTWZBWXIJQME-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C9H11NO2/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-3,6,9H,4-5,10H2
(5)Std. InChIKey: SPLTWZBWXIJQME-UHFFFAOYSA-N