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Name |
Methanone,(2-bromophenyl)-1-pyrrolidinyl- |
EINECS | N/A |
CAS No. | 124461-27-4 | Density | 1.469 g/cm3 |
PSA | 20.31000 | LogP | 2.62300 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H12BrNO | Boiling Point | 367 °C at 760 mmHg |
Molecular Weight | 254.12308 | Flash Point | 175.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | Xi:Harmful/Irritant/Keep | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Pyrrolidine,1-(2-bromobenzoyl)- (9CI); |
Article Data | 2 |
The Methanone, (2-bromophenyl)-1-pyrrolidinyl-, with the CAS registry number of 124461-27-4, is also known as 1-(2-Bromobenzoyl)pyrrolidine. It belongs to the product categories of Blocks; Bromides; Carboxes. This chemical's molecular formula is C11H12BrNO and molecular weight is 254.12308. What's more, its systematic name is called (2-Bromophenyl)(pyrrolidin-1-yl)methanone. In addition, this chemical may cause inflammation to the skin or other mucous membranes. Besides, this chemical must be kept in cold storage.
Physical properties about Methanone, (2-bromophenyl)-1-pyrrolidinyl- are: (1)ACD/LogP: 1.22; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 20.31 Å2; (7)Index of Refraction: 1.602; (8)Molar Refractivity: 59.34 cm3; (9)Molar Volume: 172.9 cm3; (10)Surface Tension: 48.7 dyne/cm; (11)Density: 1.469 g/cm3; (12)Flash Point: 175.7 °C; (13)Enthalpy of Vaporization: 61.34 kJ/mol; (14)Boiling Point: 367 °C at 760 mmHg; (15)Vapour Pressure: 1.41E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1c(Br)cccc1)N2CCCC2
(2) InChI: InChI=1/C11H12BrNO/c12-10-6-2-1-5-9(10)11(14)13-7-3-4-8-13/h1-2,5-6H,3-4,7-8H2
(3) InChIKey: MARIEGBUQWCPFS-UHFFFAOYAZ