6-Bromo-2,3-dihydro-1H-indene-1-carbonitrile


Chemical Name: 6-Bromo-2,3-dihydro-1H-indene-1-carbonitrile
CAS Number: 783335-58-0
Product Number: AG00GN4K(AGN-PC-0WAMF1)
Synonyms:
MDL No: MFCD11219697
Molecular Formula: C10H8BrN
Molecular Weight: 222.0812

Identification/Properties


Computed Properties
Molecular Weight:
222.085g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
220.984g/mol
Monoisotopic Mass:
220.984g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
217
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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