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75097-56-2 | 1-(5-Bromo-2-methoxyphenyl)cyclopentanecarbonitrile
CAS No: 75097-56-2 Catalog No: AG01EN1Z MDL No:
Product Description
Catalog Number:
AG01EN1Z
Chemical Name:
1-(5-Bromo-2-methoxyphenyl)cyclopentanecarbonitrile
CAS Number:
75097-56-2
IUPAC Name:
1-(5-bromo-2-methoxyphenyl)cyclopentane-1-carbonitrile
InChI:
InChI=1S/C13H14BrNO/c1-16-12-5-4-10(14)8-11(12)13(9-15)6-2-3-7-13/h4-5,8H,2-3,6-7H2,1H3
InChI Key:
JAFYXLCESIEQIC-UHFFFAOYSA-N
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.026g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.165g/mol
Monoisotopic Mass:
279.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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