1-(4-bromobutoxy)-4-chlorobenzene

1-(4-bromobutoxy)-4-chlorobenzene

CAS: 2033-81-0

Formula: C10H12BrClO

SMILES: ClC1=CC=C(OCCCCBr)C=C1

IUPAC: 1-(4-bromobutoxy)-4-chlorobenzene

InChI: InChI=1S/C10H12BrClO/c11-7-1-2-8-13-10-5-3-9(12)4-6-10/h3-6H,1-2,7-8H2

Composition: C (45.57%), H (4.59%), Br (30.32%), Cl (13.45%), O (6.07%)

Molar Mass: 263.56

Atom Count: 25

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	261.976006
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	DPTVPYBSBNIACI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.16
Topological Polar Surface Area	9.23
Polarizability	22.96
Ring Count	1
Rotatable Bond Count	5

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