Home Carboxys methyl 1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-8-carboxylate

methyl 1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-8-carboxylate

CAS No.:
1499207-49-6
Catalog Number:
AG01DVES
Molecular Formula:
C9H12N2O2
Molecular Weight:
180.2038
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Product Description
Catalog Number:
AG01DVES
Chemical Name:
methyl 1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-8-carboxylate
CAS Number:
1499207-49-6
Molecular Formula:
C9H12N2O2
Molecular Weight:
180.2038
MDL Number:
MFCD31617463
IUPAC Name:
methyl 1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-8-carboxylate
InChI:
InChI=1S/C9H12N2O2/c1-13-9(12)7-2-4-11-5-3-10-6-8(7)11/h2,4,10H,3,5-6H2,1H3
InChI Key:
IONSRGDHHCMINV-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccn2c1CNCC2
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.207g/mol
Monoisotopic Mass:
180.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties