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1124-14-7

1124-14-7 | 1-Bromo-4-cyclopropylbenzene

CAS No: 1124-14-7 Catalog No: AG003883 MDL No:MFCD00101828

Product Description

Catalog Number:
AG003883
Chemical Name:
1-Bromo-4-cyclopropylbenzene
CAS Number:
1124-14-7
Molecular Formula:
C9H9Br
Molecular Weight:
197.0718
MDL Number:
MFCD00101828
IUPAC Name:
1-bromo-4-cyclopropylbenzene
InChI:
InChI=1S/C9H9Br/c10-9-5-3-8(4-6-9)7-1-2-7/h3-7H,1-2H2
InChI Key:
JRDNBWVMEFUNCQ-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C1CC1

Properties

Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.989g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.075g/mol
Monoisotopic Mass:
195.989g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

Literature

Title Journal
An exploratory study of ring closures of aryl radicals onto cyclopropyl- and oxiranyl-isocyanate acceptors. Organic & biomolecular chemistry 20040907

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