(3-bromo-4-chlorophenyl)(cyclopropyl)methanone

(3-bromo-4-chlorophenyl)(cyclopropyl)methanone

CAS: 1280786-94-8

Formula: C10H8BrClO

SMILES: ClC1=CC=C(C=C1Br)C(=O)C1CC1

IUPAC: (3-bromo-4-chlorophenyl)(cyclopropyl)methanone

InChI: InChI=1S/C10H8BrClO/c11-8-5-7(3-4-9(8)12)10(13)6-1-2-6/h3-6H,1-2H2

Composition: C (46.28%), H (3.11%), Br (30.79%), Cl (13.66%), O (6.16%)

Molar Mass: 259.53

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	257.944706
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	KYWLRCNRAPNWNL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.29
Topological Polar Surface Area	17.07
Polarizability	21.77
Ring Count	2
Rotatable Bond Count	2

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