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124276-75-1 | Cyclopropanecarbonitrile, 1-(2-bromophenyl)-
CAS No: 124276-75-1 Catalog No: AG000LSC MDL No:MFCD07374407
Product Description
Catalog Number:
AG000LSC
Chemical Name:
Cyclopropanecarbonitrile, 1-(2-bromophenyl)-
CAS Number:
124276-75-1
Molecular Formula:
C10H8BrN
Molecular Weight:
222.0812
MDL Number:
MFCD07374407
IUPAC Name:
1-(2-bromophenyl)cyclopropane-1-carbonitrile
InChI:
InChI=1S/C10H8BrN/c11-9-4-2-1-3-8(9)10(7-12)5-6-10/h1-4H,5-6H2
InChI Key:
QGRRKIFTSXBLNX-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)c1ccccc1Br
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.984g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.085g/mol
Monoisotopic Mass:
220.984g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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