Home Nitriles 1-methyl-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-6-carbonitrile hydrochloride

1-methyl-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-6-carbonitrile hydrochloride

CAS No.:
1172808-44-4
Catalog Number:
AG019LLA
Molecular Formula:
C9H12ClN3
Molecular Weight:
197.6647
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Product Description
Catalog Number:
AG019LLA
Chemical Name:
1-methyl-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-6-carbonitrile hydrochloride
CAS Number:
1172808-44-4
Molecular Formula:
C9H12ClN3
Molecular Weight:
197.6647
MDL Number:
MFCD11099402
IUPAC Name:
1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-6-carbonitrile;hydrochloride
InChI:
InChI=1S/C9H11N3.ClH/c1-7-9-3-2-8(6-10)12(9)5-4-11-7;/h2-3,7,11H,4-5H2,1H3;1H
InChI Key:
GUJIWPSHUHZTGI-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2n1CCNC2C.Cl
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.072g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.666g/mol
Monoisotopic Mass:
197.072g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties