Home Halogens 3-chloro-1-(2-methylpropyl)-1,2-dihydropyrazin-2-one

3-chloro-1-(2-methylpropyl)-1,2-dihydropyrazin-2-one

CAS No.:
1423025-01-7
Catalog Number:
AG01A9VH
Molecular Formula:
C8H11ClN2O
Molecular Weight:
186.6387
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Product Description
Catalog Number:
AG01A9VH
Chemical Name:
3-chloro-1-(2-methylpropyl)-1,2-dihydropyrazin-2-one
CAS Number:
1423025-01-7
Molecular Formula:
C8H11ClN2O
Molecular Weight:
186.6387
MDL Number:
MFCD22578751
IUPAC Name:
3-chloro-1-(2-methylpropyl)pyrazin-2-one
InChI:
InChI=1S/C8H11ClN2O/c1-6(2)5-11-4-3-10-7(9)8(11)12/h3-4,6H,5H2,1-2H3
InChI Key:
REUBHUUTGHXUBQ-UHFFFAOYSA-N
SMILES:
CC(Cn1ccnc(c1=O)Cl)C
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.056g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.639g/mol
Monoisotopic Mass:
186.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties