4-(2-bromoethoxy)-1-chloro-2-methylbenzene

4-(2-bromoethoxy)-1-chloro-2-methylbenzene

CAS: 6440-89-7

Formula: C9H10BrClO

SMILES: CC1=C(Cl)C=CC(OCCBr)=C1

IUPAC: 4-(2-bromoethoxy)-1-chloro-2-methylbenzene

InChI: InChI=1S/C9H10BrClO/c1-7-6-8(12-5-4-10)2-3-9(7)11/h2-3,6H,4-5H2,1H3

Composition: C (43.32%), H (4.04%), Br (32.02%), Cl (14.21%), O (6.41%)

Molar Mass: 249.53

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	247.960356
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	QTMOHEJWUQAGMV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.69
Topological Polar Surface Area	9.23
Polarizability	21.07
Ring Count	1
Rotatable Bond Count	3

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