5-Benzoxazolamine,2-methyl- supplier

Name
2-METHYL-1,3-BENZOXAZOL-5-AMINE
EINECS
CAS No. 72745-76-7
Article Data12
CAS DataBase
Density 1.254 g/cm³
Solubility
Melting Point 50-53 °C
Formula C₈H₈N₂O
Boiling Point 290.6 °C at 760 mmHg
Molecular Weight 148.164
Flash Point 129.6 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 5-Amino-2-methyl-1,3-benzoxazole;
PSA 52.05000
LogP 2.29960

5-Benzoxazolamine,2-methyl- Specification

The 5-Benzoxazolamine,2-methyl-, with the CAS registry number of 72745-76-7, is also known as 5-Amino-2-methyl-1,3-benzoxazole. It belongs to the product categories of Amines; Oxazoles, Isoxazoles & Benzoxazoles; Oxazoles, Isoxazoles & Benzoxazoles. This chemical's molecular formula is C₈H₈N₂O and molecular weight is 148.16. What's more, its IUPAC name is 2-Methyl-1,3-benzoxazol-5-amine.

Physical properties about the 5-Benzoxazolamine,2-methyl- are: (1)ACD/LogP: 0.54; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 29.27 Å²; (7)Index of Refraction: 1.658; (8)Molar Volume: 118.1 cm³; (9)Surface Tension: 55.7 dyne/cm; (10)Density: 1.254 g/cm³; (11)Flash Point: 129.6 °C; (12)Enthalpy of Vaporization: 53 kJ/mol; (13)Boiling Point: 290.6 °C at 760 mmHg; (14)Vapour Pressure: 0.00205 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In addition, during using it, wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1) SMILES: n1c2cc(ccc2oc1C)N
(2) InChI: InChI=1/C8H8N2O/c1-5-10-7-4-6(9)2-3-8(7)11-5/h2-4H,9H2,1H3
(3) InChIKey: FECYTFWPNCBIHC-UHFFFAOYAM

Product Name

2-METHYL-1,3-BENZOXAZOL-5-AMINE

5-Benzoxazolamine,2-methyl- Specification

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