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Home > Bromides > 121562-08-1

121562-08-1

121562-08-1 | 1,2,4-Oxadiazole, 3-bromo-5-cyclopropyl-

CAS No: 121562-08-1 Catalog No: AG00159K MDL No:MFCD12827917

Product Description

Catalog Number:
AG00159K
Chemical Name:
1,2,4-Oxadiazole, 3-bromo-5-cyclopropyl-
CAS Number:
121562-08-1
Molecular Formula:
C5H5BrN2O
Molecular Weight:
189.0100
MDL Number:
MFCD12827917
IUPAC Name:
3-bromo-5-cyclopropyl-1,2,4-oxadiazole
InChI:
InChI=1S/C5H5BrN2O/c6-5-7-4(9-8-5)3-1-2-3/h3H,1-2H2
InChI Key:
SKWIAZWIYKVAIP-UHFFFAOYSA-N
SMILES:
Brc1noc(n1)C1CC1

Properties

Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.959g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.012g/mol
Monoisotopic Mass:
187.959g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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