Methanone,(2-bromophenyl)-1-pyrrolidinyl- supplier

Name
(2-BROMOPHENYL)(PYRROLIDIN-1-YL)METHANONE
EINECS
CAS No. 124461-27-4
Article Data2
CAS DataBase
Density 1.469 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₂BrNO
Boiling Point 367 °C at 760 mmHg
Molecular Weight 254.12308
Flash Point 175.7 °C
Transport Information
Appearance
Safety
Risk Codes Xi:Harmful/Irritant/Keep
Molecular Structure
Hazard Symbols Xi
Synonyms Pyrrolidine,1-(2-bromobenzoyl)- (9CI);
PSA 20.31000
LogP 2.62300

Methanone,(2-bromophenyl)-1-pyrrolidinyl- Specification

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

Product Name

(2-BROMOPHENYL)(PYRROLIDIN-1-YL)METHANONE

Methanone,(2-bromophenyl)-1-pyrrolidinyl- Specification

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