(5-bromo-2-chlorophenyl)(4-fluorophenyl)methanone manufacturers and suppliers on PharmaCompass

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Also known as: 915095-85-1, (5-bromo-2-chlorophenyl)-(4-fluorophenyl)methanone, Schembl2637828, Amy39947, Mfcd12410140, Zinc34775740
Molecular Formula
C13H7BrClFO
Molecular Weight
313.55  g/mol
InChI Key
LVILQFKAGQFQEK-UHFFFAOYSA-N

(5-bromo-2-chlorophenyl)(4-fluorophenyl)methanone
1 2D Structure

(5-bromo-2-chlorophenyl)(4-fluorophenyl)methanone

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(5-bromo-2-chlorophenyl)-(4-fluorophenyl)methanone
2.1.2 InChI
InChI=1S/C13H7BrClFO/c14-9-3-6-12(15)11(7-9)13(17)8-1-4-10(16)5-2-8/h1-7H
2.1.3 InChI Key
LVILQFKAGQFQEK-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1C(=O)C2=C(C=CC(=C2)Br)Cl)F
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 915095-85-1

2. (5-bromo-2-chlorophenyl)-(4-fluorophenyl)methanone

3. Schembl2637828

4. Amy39947

5. Mfcd12410140

6. Zinc34775740

7. Akos005831751

8. Bs-17834

9. Db-120590

10. Cs-0162265

11. D84028

12. (5-bromo-2-chlorophenyl)(4-fluorophenyl) Methanone

13. Methanone, (5-bromo-2-chlorophenyl)(4-fluorophenyl)-

2.3 Create Date
2007-02-21
3 Chemical and Physical Properties
Molecular Weight 313.55 g/mol
Molecular Formula C13H7BrClFO
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass311.93528 g/mol
Monoisotopic Mass311.93528 g/mol
Topological Polar Surface Area17.1 Ų
Heavy Atom Count17
Formal Charge0
Complexity279
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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