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tert-butyl 1-(4-bromophenyl)cyclopropane-1-carboxylate

tert-butyl 1-(4-bromophenyl)cyclopropane-1-carboxylate

CAS: 345965-53-9

Formula: C14H17BrO2

SMILES: CC(C)(C)OC(=O)C1(CC1)C1=CC=C(Br)C=C1

IUPAC: tert-butyl 1-(4-bromophenyl)cyclopropane-1-carboxylate

InChI: InChI=1S/C14H17BrO2/c1-13(2,3)17-12(16)14(8-9-14)10-4-6-11(15)7-5-10/h4-7H,8-9H2,1-3H3

Composition: C (56.58%), H (5.77%), Br (26.89%), O (10.77%)

Molar Mass: 297.192

Atom Count: 34

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 296.041193
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey OCIDCJXKYGNZCU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.84
Topological Polar Surface Area 26.3
Polarizability 27.84
Ring Count 2
Rotatable Bond Count 4

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