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Home > Bromides > 1404367-14-1
1404367-14-1 | 4-Pyridinecarbonitrile, 3-bromo-5-cyclopropyl-
CAS No: 1404367-14-1 Catalog No: AG001CFA MDL No:
Product Description
Catalog Number:
AG001CFA
Chemical Name:
4-Pyridinecarbonitrile, 3-bromo-5-cyclopropyl-
CAS Number:
1404367-14-1
Molecular Formula:
C9H7BrN2
Molecular Weight:
223.0693
IUPAC Name:
3-bromo-5-cyclopropylpyridine-4-carbonitrile
InChI:
InChI=1S/C9H7BrN2/c10-9-5-12-4-8(6-1-2-6)7(9)3-11/h4-6H,1-2H2
InChI Key:
FXBWXMNXNUKNLG-UHFFFAOYSA-N
SMILES:
N#Cc1c(Br)cncc1C1CC1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.979g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.073g/mol
Monoisotopic Mass:
221.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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