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Home > Bromides > 1314760-71-8
1314760-71-8 | Cyclopropanecarbonitrile, 1-(4-bromo-3-methylphenyl)-
CAS No: 1314760-71-8 Catalog No: AG000W93 MDL No:MFCD19692817
Product Description
Catalog Number:
AG000W93
Chemical Name:
Cyclopropanecarbonitrile, 1-(4-bromo-3-methylphenyl)-
CAS Number:
1314760-71-8
Molecular Formula:
C11H10BrN
Molecular Weight:
236.1078
MDL Number:
MFCD19692817
IUPAC Name:
1-(4-bromo-3-methylphenyl)cyclopropane-1-carbonitrile
InChI:
InChI=1S/C11H10BrN/c1-8-6-9(2-3-10(8)12)11(7-13)4-5-11/h2-3,6H,4-5H2,1H3
InChI Key:
XAIQSXRKYAMDRT-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)c1ccc(c(c1)C)Br
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.112g/mol
Monoisotopic Mass:
235g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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